C44H53FN7O8 Guanosine, 5'-O- [bis(4-methoxyphenyl) phenylmethyl]-2'-deoxy-2'- fluoro-N-(2-methyl-1-oxopropyl)-, 3'- [2-cyanoethyl N, N-bis (1-methyl ethyl) phosphoramite (ACI)

alaabta

C44H53FN7O8 Guanosine, 5'-O- [bis(4-methoxyphenyl) phenylmethyl]-2'-deoxy-2'- fluoro-N-(2-methyl-1-oxopropyl)-, 3'- [2-cyanoethyl N, N-bis (1-methyl ethyl) phosphoramite (ACI)

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Faahfaahinta Alaabta

Tags Product

Faahfaahinta Walaxda

Lambarka Diiwaanka CAS

144089-97-4

Qalabka Jidhka ee Furaha ah Qiimaha Xaalad
Miisaanka Molecular 857.91 -
pKa (La saadaaliyay) 9.16±0.20 Heerkulka ugu acidic badan: 25 °C

Magacyo Kale iyo Aqoonsiyo

Dhoola-cadaynta Canonical

N#CCCOP(OC1C(F)C(OC1COC(C=2C=CC=CC2)(C3=CC=C(OC)C=C3)C4=CC=C(OC)C=C4)N5C= NC=6C (=O)N=C(NC(=O)C(C)C)NC65)N(C(C) C)C(C)C

Dhoola-caddeyn

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

InChi

InChi= 1S/C44H53FN7O8P/c1-27(2)40(53)49-43-48-39-37(41(54)50-43)47-26-51(39)42-36(45)38(60-) 61(58-24-12-23-46)52(28(3)4)29(5) 6)35(59-42)25-57-44(30-13-10-9-11-14-30,31-15-19-33(55-7)20-16- 31)32-17-21-34(56-8)22-18-32/h9-11,13-22,26-29,35-36,38,42H,12, 24-25H2,1-8H3,(H2,48,49,50,53,54)/t35-,36-,38-,42-,61?/m1/s1

Furaha InChi

KJFUMXZZVYMQEU-AOCJBPQJSA-N

1 Magaca kale ee walaxdan

Guanosin, 5′-O- [bis (4-methoxyphenyl) phenylmethyl]-2'-deoxy-2'-fluoro-N-(2-methyl-1-oxopropyl)-, 3′- [2-cyanoethyl bis (1-methyl ethyl) fosphoramite] (9CI)

Guryaha la saadaaliyay

Guryaha la heli karo
Nafley
Kiimiko
Lipinski
Qaab-dhismeedka La Xiriira

Nafley

Hanti Qiimaha Xaalad Xigasho
Qodobka bioconcentration 298 pH 1; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 6350 pH 2; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 57800 pH 3; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 1.76 x 105 pH 4; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 2.21 x 105 pH 5; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 2.26 x 105 pH 6; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 2.24 x 105 pH 7; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 2.03 x 105 pH 8; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 1.04 x 105 pH 9; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 19300kii pH 10; Heerkulka: 25 °C (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Kiimiko

Isha Xaaladda Qiimaha Hantida
Koc 312 pH 1; Heerkulka: 25 °C (1) ACD
Koc 6630 pH 2; Heerkulka: 25 °C (1) ACD
Koc 60400 pH 3; Heerkulka: 25 °C (1) ACD
Koc 1.84 x 105 pH 4; Heerkulka: 25 °C (1) ACD
Koc 2.31 x 105 pH 5; Heerkulka: 25 °C (1) ACD
Koc 2.37 x 105 pH 6; Heerkulka: 25 °C (1) ACD
Koc 2.35 x 105 pH 7; Heerkulka: 25 °C (1) ACD
Koc 2.12 x 105 pH 8; Heerkulka: 25 °C (1) ACD
Koc 1.08 x 105 pH 9; Heerkulka: 25 °C (1) ACD
Koc 20200 pH 10; Heerkulka: 25 °C (1) ACD
logD 4.47 pH 1; Heerkulka: 25 °C (1) ACD
logD 5.80 pH 2; Heerkulka: 25 °C (1) ACD

 

Hanti Qiimaha Xaalad Xigasho
logD 6.76 pH 3; Heerkulka: 25 °C (1) ACD
logD 7.24 pH 4; Heerkulka: 25 °C (1) ACD
logD 7.34 pH 5; Heerkulka: 25 °C (1) ACD
logD 7.35 pH 6; Heerkulka: 25 °C (1) ACD
logD 7.35 pH 7; Heerkulka: 25 °C (1) ACD
logD 7.30 pH 8; Heerkulka: 25 °C (1) ACD
logD 7.01 pH 9; Heerkulka: 25 °C (1) ACD
logD 6.28 pH 10; Heerkulka: 25 °C (1) ACD
logP 7.351± 0.713 Heerkulka: 25 °C (1) ACD
Solubility Mass Intrinsic 3.0 x 10-5 g/L Heerkulka: 25 °C (1) ACD
Solubility Mass 0.022 g/L pH 1; Heerkulka: 25 °C (1) ACD
Solubility Mass 1.0 x 10-3 g/L pH 2; Heerkulka: 25 °C (1) ACD
Solubility Mass 1.2 x 10-4 g/L pH 3; Heerkulka: 25 °C (1) ACD
Solubility Mass 3.9 x 10-5 g/L pH 4; Heerkulka: 25 °C (1) ACD
Solubility Mass 3.1 x 10-5 g/L pH 5; Heerkulka: 25 °C (1) ACD
Solubility Mass 3.0 x 10-5 g/L pH 6; Heerkulka: 25 °C (1) ACD
Solubility Mass 3.0 x 10-5 g/L pH 7; Heerkulka: 25 °C (1) ACD
Solubility Mass 3.3 x 10-5 g/L pH 8; Heerkulka: 25 °C (1) ACD
Solubility Mass 6.5 x 10-5 g/L pH 9; Heerkulka: 25 °C (1) ACD
Solubility Mass 3.5 x 10-4 g/L pH 10; Heerkulka: 25 °C (1) ACD
Solubility Mass 3.0 x 10-5 g/L Biyaha aan la daboolin pH 7.00; Heerkulka: 25 °C (1) ACD
Solubility Intrinsic Molar 3.5 x 10-8 mol/L Heerkulka: 25 °C (1) ACD
Solubility Molar 2.6 x 10-5 mol/L pH 1; Heerkulka: 25 °C (1) ACD
Solubility Molar 1.2 x 10-6 mol/L pH 2; Heerkulka: 25 °C (1) ACD
Solubility Molar 1.4 x 10-7 mol/L pH 3; Heerkulka: 25 °C (1) ACD
Solubility Molar 4.5 x 10-8 mol/L pH 4; Heerkulka: 25 °C (1) ACD
Solubility Molar 3.6 x 10-8 mol/L pH 5; Heerkulka: 25 °C (1) ACD
Solubility Molar 3.5 x 10-8 mol/L pH 6; Heerkulka: 25 °C (1) ACD
Solubility Molar 3.5 x 10-8 mol/L pH 7; Heerkulka: 25 °C (1) ACD
Solubility Molar 3.9 x 10-8 mol/L pH 8; Heerkulka: 25 °C (1) ACD
Solubility Molar 7.6 x 10-8 mol/L pH 9; Heerkulka: 25 °C (1) ACD
Solubility Molar 4.1 x 10-7 mol/L pH 10; Heerkulka: 25 °C (1) ACD

 

Hanti Qiimaha Xaalad Xigasho
Solubility Molar 3.5 x 10-8 mol/L Biyaha aan la daboolin pH 7.00; Heerkulka: 25 °C (1) ACD
Miisaanka Molecular 857.91    
pKa 9.16±0.20 Heerkulka ugu acidic badan: 25 °C (1) ACD
pKa 3.45 ± 0.70 Heerkulka ugu badan ee aasaasiga ah: 25 °C (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Qaab-dhismeedka La Xiriira

Hanti Qiimaha Isha Xaaladda
Aagga dusha sare ee Polar 184 A2 (1) ACD

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Hanti Qiimaha Xaalad Xigasho
Boondhigyo si xor ah loo wareejin karo 18   (1) ACD
H Aqbalayaasha 15   (1) ACD
H Deeq-bixiyayaasha 2   (1) ACD
Ku-deeqaha/Aqbalka Wadarta 17   (1) ACD
logP 7.351± 0.713 Heerkulka: 25 °C (1) ACD
Miisaanka Molecular 857.91    

(1) Waxaa la xisaabiyay iyadoo la isticmaalayo Horumarinta Kiimikada Sare (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)


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