C47H60N7O10P Guanosine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-(2- methoxyethyl)-N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N,N-bis (1-methylethyl)phosphoramidite] (ACI)

productio

C47H60N7O10P Guanosine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-(2- methoxyethyl)-N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N,N-bis (1-methylethyl)phosphoramidite] (ACI)

Basic Information:


Product Detail

Product Tags

Substantia detail

Cas Subcriptio Number

251647-55-9

H302

Key physica proprietatibus Valor Conditio
Pondus 914.00 -
Pka (praedicta) 9.16 ± 0.20 Most Acidic Temp: XXV ° C

Alia nomina et identifiers

Canonica ridet

N#CCCOP(OC1C(OC(N2C= NC=3C(=O)N=C(NC(=O)C(C)C)NC32)C1OCCOC)COC(C=4C=CC=CC4)(C5=CC=C(OC)C=C5)C6=CC=C(OC)C=C6) N(C(C)C)C(C)C

Isomeric smiles

C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](OCCOC)[C@@H](O1)N2C3=C(N=C2)C(=O)N=C(NC(C(C)C)=O)N3)(C4=CC=C (O) C = C4), (C5 = c (C) C = C5) C6 cc = CC = C6

INCHI

Inchi = 1s / C47H60N7O10P / C1-30 (II) XLIII (LV) 51-46-50-42-39 (XLIV (LVI) 52-46) 49-29-53 (XLII) 45-41 (62-25-13-24-7) LIV (60-25-13-24-7) LIV (62-25-13-24-7) LIV ( 31(3)4)32(5)6)38(63-45)28-61-47(33-14-11-10-12-15-33,34-16-20-36(58-8)21-17-34)35-18-22-37(59-9)23-19-35/h10-12,14-23,29-32,38 , 40-41,45H, 13,25-28H2,1-9H3 (H2,50,51,52,55,56) / T38-, 41-, 41-, 45-, LXV? / M1 / ​​S1

Key Inchi

Ladcdgnebiqaau, sbcraqivsa, n

XVII alia nomina huius substantiae

Guanosine, V '-O- [bis (IV-metoxyphen) Phenylmethyl] -2 '-O- (II-methoxyethyl) -N- (II-methyl-I-oxopropyl) -, III, - [II-cyanoethyl bis (1. methyshylethyl) phosphoramidite] (9CI); XVII: PN: US20030212017 Page: XX petita sequence; XVIII: PN: US20030211606 Page: XX

petita sequence; XIX: PN: US20040005569 Page: XXII petita sequence; XXI: PN: US20040006030 Page: XXIII petita sequence; XXI: PN: US20040014047 Page: XXI petita sequence; XXI: PN: US20040014049 Page: XXI petita sequence; XXII: PN: US20030198965 Pag

E: XX petita sequence; XXII: PN: US20040005570 Page: XXI petita sequence; XXII: PN: US20040014048 Page: XXI petita sequence;

XXII: PN: US20040014050 Page: XXI petita sequence; XXIII: PN: US20040005565 Page: 17- XXII petita sequence; XXIII: PN: us20040

(MCD) LI Page: XXIII petita sequence; XXIV: PN: US20040014699 Page: XXI petita sequence; XXV: PN: US20040006029 Page: XXIII petita sequence; XXV: PN: Wo03106645 Page: LXXIII petita sequence; XCVI: PN: US20040005707 Page: XXI petita sequence

Experimentalem spectra

Spectra praesto
XIII c NMR
Nmr hetero

Praedixit possessiones

Proprietatibus praesto
Biological
Proiectus
Lipinski
Structuram related

Biological

Res Valor Conditio Fons
Bioconcentration factor CXXI PH I; Temp: XXV ° C (I) ACD
Bioconcentration factor MMDLXXX PH II; Temp: XXV ° C (I) ACD
Bioconcentration factor (XXIII) D PH III; Temp: XXV ° C (I) ACD
Bioconcentration factor (LXXI) DCCC PH IV; Temp: XXV ° C (I) ACD
Bioconcentration factor (LXXXIX) DCCC PH V; Temp: XXV ° C (I) ACD
Bioconcentration factor (XCII) C Ph VI; Temp: XXV ° C (I) ACD
Bioconcentration factor (IX) CCCXX PH VII; Temp: XXV ° C (I) ACD
Bioconcentration factor (LXXX )ber00 PH VIII; Temp: XXV ° C (I) ACD
Bioconcentration factor (XLII) CC PH IX; Temp: XXV ° C (I) ACD
Bioconcentration factor (VII) DCCCLX PH X; Temp: XXV ° C (I) ACD

(I) Calculus in ratione progressionem progressionem (ACD / Labs) Software V11.02 (© 1994-2023 ACD / Labs)

Proiectus

Res Valor Conditio Fons
Koc CLXIV PH I; Temp: XXV ° C (I) ACD
Koc MMMCDLXXX PH II; Temp: XXV ° C (I) ACD
Koc (XXXI) DCC PH III; Temp: XXV ° C (I) ACD
Koc (XCVI) CM PH IV; Temp: XXV ° C (I) ACD
Koc 1.21 x CV PH V; Temp: XXV ° C (I) ACD

 

Res Valor Conditio Fons
Koc 1.24 x CV Ph VI; Temp: XXV ° C (I) ACD
Koc 1.23 x CV PH VII; Temp: XXV ° C (I) ACD
Koc X 1.11 CV PH VIII; Temp: XXV ° C (I) ACD
Koc (LVI) CM PH IX; Temp: XXV ° C (I) ACD
Koc (X) DC PH X; Temp: XXV ° C (I) ACD
logd 3.95 PH I; Temp: XXV ° C (I) ACD
logd 5,28 PH II; Temp: XXV ° C (I) ACD
logd 6,24 PH III; Temp: XXV ° C (I) ACD
logd 6,73 PH IV; Temp: XXV ° C (I) ACD
logd 6.82 PH V; Temp: XXV ° C (I) ACD
logd 6,83 Ph VI; Temp: XXV ° C (I) ACD
logd 6,83 PH VII; Temp: XXV ° C (I) ACD
logd 6,79 PH VIII; Temp: XXV ° C (I) ACD
logd 6,50 PH IX; Temp: XXV ° C (I) ACD
logd 5.77 PH X; Temp: XXV ° C (I) ACD
logp 6,837 ± 0.764 Temp: XXV ° C (I) ACD
Missam intrinsecam solubility X 10-4 G / l Temp: XXV ° C (I) ACD
Missam solubility 0,34 G / l PH I; Temp: XXV ° C (I) ACD
Missam solubility 0.016 g / l PH II; Temp: XXV ° C (I) ACD
Missam solubility 1.7 X 10-3 g / l PH III; Temp: XXV ° C (I) ACD
Missam solubility 5.7 x 10-4 g / l PH IV; Temp: XXV ° C (I) ACD
Missam solubility 4.6 x 10-4 g / l PH V; Temp: XXV ° C (I) ACD
Missam solubility X 10-4 G / l Ph VI; Temp: XXV ° C (I) ACD
Missam solubility 10-4 X 10-4 G / l PH VII; Temp: XXV ° C (I) ACD
Missam solubility 10-4 10-4 g / l PH VIII; Temp: XXV ° C (I) ACD
Missam solubility X 10-3 g / l PH IX; Temp: XXV ° C (I) ACD
Missam solubility 5.2 x 10-3 g / l PH X; Temp: XXV ° C (I) ACD
Missam solubility 10-4 X 10-4 G / l Unbuffered aqua PH 6.99; Temp: XXV ° C (I) ACD
Molaris intrinsecam solubility 4.8 x 10-7 Mol / l Temp: XXV ° C (I) ACD
Molaris solubility 10-4 Mol X 3.7 / l PH I; Temp: XXV ° C (I) ACD
Molaris solubility 1.7 X 10-5 Mol / l PH II; Temp: XXV ° C (I) ACD
Molaris solubility 1.9 x 10-6 Mol / l PH III; Temp: XXV ° C (I) ACD

 

Res Valor Conditio Fons
Molaris solubility 6,2 x 10-7 Mol / l PH IV; Temp: XXV ° C (I) ACD
Molaris solubility 5.0 x 10-7 Mol / l PH V; Temp: XXV ° C (I) ACD
Molaris solubility 4.8 x 10-7 Mol / l Ph VI; Temp: XXV ° C (I) ACD
Molaris solubility 4.9 x 10-7 Mol / l PH VII; Temp: XXV ° C (I) ACD
Molaris solubility 5.4 x 10-7 Mol / l PH VIII; Temp: XXV ° C (I) ACD
Molaris solubility X 10-6 Mol X / l PH IX; Temp: XXV ° C (I) ACD
Molaris solubility 5.7 x 10-6 Mol / l PH X; Temp: XXV ° C (I) ACD
Molaris solubility 4.9 x 10-7 Mol / l Unbuffered aqua PH 6.99; Temp: XXV ° C (I) ACD
Pondus 914.00    
PKA 9.16 ± 0.20 Most Acidic Temp: XXV ° C (I) ACD
PKA 3.45 ± 0.70 Maxime basic temp: XXV ° (I) ACD

(I) Calculus in ratione progressionem progressionem (ACD / Labs) Software V11.02 (© 1994-2023 ACD / Labs)

Lipinski

Res Valor Conditio Fons
Sponte Rotatable vincula 22   (I) ACD
H acceptors 17   (I) ACD
H donos 2   (I) ACD
H donator / Acceptor Sum 19   (I) ACD
logp 6,837 ± 0.764 Temp: XXV ° C (I) ACD
Pondus 914.00    

(I) Calculus in ratione progressionem progressionem (ACD / Labs) Software V11.02 (© 1994-2023 ACD / Labs)

Structuram related

Res Valor Source
Polar superficies regio CCIII A2 (I) ACD

(I) Calculus in ratione progressionem progressionem (ACD / Labs) Software V11.02 (© 1994-2023 ACD / Labs)

Praedicta Spectra

Spectra praesto
I h NMR
XIII c NMR

GHS aleam dicta

Code aleam dicitur Source
H302 nocivis, si absorbuit Europae chemical Agency (ECA) Classification & Labeling

Inventory - Notified Classification et Labeling - Most Clementine_Vulgate Suspendisse, Europae Chemical Agency (ECA)

Classification & Labeling Inventory - Notified Classification et Labeling - Most Suspendisse


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