C36H39N5O8 Guanosine, 5'-O-[bis(4-methoxyphenyl) phenylmethyl]-2'-O-methyl- N- (2-methyl-1-oxopropyl) - (9CI, ACI)

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C36H39N5O8 Guanosine, 5'-O-[bis(4-methoxyphenyl) phenylmethyl]-2'-O-methyl- N- (2-methyl-1-oxopropyl) - (9CI, ACI)

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Faahfaahinta Alaabta

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Tilmaamaha jirka

Qalabka Jidhka ee Furaha ah Qiimaha Xaalad
Miisaanka Molecular 669.72 -
Cufnaanta (La saadaaliyay) 1.35±0.1 g/cm3 Heerkulka: 20 °C; Riix: 760 Torr
pKa (La saadaaliyay) 9.16±0.20 Heerkulka ugu acidic badan: 25 °C

Magacyada iyo Aqoonsiyada Kale

Dhoola caddaynta O=C1N=C(NC(=O)C(C)C)NC2=C1N=CN2C3OC(COC(C=4C=CC=CC4)(C5=CC=C(OC)C=C5)C6= CC=C(OC)C=C6)C(O)C3OC
Dhoola-caddeyn
C (OC[C@H]1O[C@H]([C@H](OC)[C@@H]1O C(C)C=O)N3)(C4=CC=C(OC)C=C4)(C5=CC=C(OC)C=C5)C6=CC
=CC=C6
InChi
InChi=1S/C36H39N5O8/c1-21(2)32(43)39-35-38-31-28(33(44)40-35)37-20-41(31)34-30(47-5) 29(42)27(49-34)19-48-36(22-9-7-6-8-10-2 2,23-11-15-25(45-3)16-12-23)24 -13-17-26(46-4)18-14-24/h6-18,20-21,27,29-30,34,42H,19H2,1-5H3,(H2,38,39,40, 43,44)/t27-,29-,30-,34
-/m1/s1
Furaha InChi
ISQLJOGRNUQHJX-WIFIACMTSA-N
1 Magaca kale ee walaxdan
5′-O-[Bis (4-methoxyphenyl) phenylmethyl]-2′-O-methyl-N-(2-methyl-1-oxopropyl) guanosine (ACI)

Guryaha la saadaaliyay

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

Nafley

Hanti Qiimaha Xaalad Xigasho
Qodobka bioconcentration 797 pH 1; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 2030 pH 2; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 2400 pH 3; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 2450 pH 4; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 2450 pH 5; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 2450 pH 6; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 2420 pH 7; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 2170 pH 8; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 1070 pH 9; Heerkulka: 25 °C (1) ACD
Qodobka bioconcentration 195 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

Hanti Qiimaha Xaalad Xigasho
Koc 3020 pH 1; Heerkulka: 25 °C (1) ACD
Koc 7680 pH 2; Heerkulka: 25 °C (1) ACD
Koc 9100 pH 3; Heerkulka: 25 °C (1) ACD
Koc 9270 pH 4; Heerkulka: 25 °C (1) ACD
Koc 9290 pH 5; Heerkulka: 25 °C (1) ACD
Koc 9280 pH 6; Heerkulka: 25 °C (1) ACD
Koc 9170 pH 7; Heerkulka: 25 °C (1) ACD
Koc 8220 pH 8; Heerkulka: 25 °C (1) ACD
Koc 4050 pH 9; Heerkulka: 25 °C (1) ACD
Koc 737 pH 10; Heerkulka: 25 °C (1) ACD
logD 4.27 pH 1; Heerkulka: 25 °C (1) ACD
logD 4.68 pH 2; Heerkulka: 25 °C (1) ACD

 

Hanti Qiimaha Xaalad Xigasho
logD 4.75 pH 3; Heerkulka: 25 °C (1) ACD
logD 4.76 pH 4; Heerkulka: 25 °C (1) ACD
logD 4.76 pH 5; Heerkulka: 25 °C (1) ACD
logD 4.76 pH 6; Heerkulka: 25 °C (1) ACD
logD 4.76 pH 7; Heerkulka: 25 °C (1) ACD
logD 4.71 pH 8; Heerkulka: 25 °C (1) ACD
logD 4.40 pH 9; Heerkulka: 25 °C (1) ACD
logD 3.66 pH 10; Heerkulka: 25 °C (1) ACD
logP 4.763 ± 0.722 Heerkulka: 25 °C (1) ACD
Solubility Mass Intrinsic 3.1 x 10-4 g/L Heerkulka: 25 °C (1) ACD
Xalka tirada badan 9.4 x 10-4 g/L pH 1; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 3.7 x 10-4 g/L pH 2; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 3.1 x 10-4 g/L pH 3; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 3.1 x 10-4 g/L pH 4; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 3.1 x 10-4 g/L pH 5; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 3.1 x 10-4 g/L pH 6; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 3.1 x 10-4 g/L pH 7; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 3.5 x 10-4 g/L pH 8; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 7.4 x 10-4 g/L pH 9; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 3.9 x 10-3 g/L pH 10; Heerkulka: 25 °C (1) ACD
Xalka tirada badan 3.1 x 10-4 g/L Biyaha aan la daboolin pH 6.99; Heerkulka: 25 °C (1) ACD
Solubility Intrinsic Molar 4.6 x 10-7 mol/L Heerkulka: 25 °C (1) ACD
Solubility Molar 1.4 x 10-6 mol/L pH 1; Heerkulka: 25 °C (1) ACD
Solubility Molar 5.5 x 10-7 mol/L pH 2; Heerkulka: 25 °C (1) ACD
Solubility Molar 4.7 x 10-7 mol/L pH 3; Heerkulka: 25 °C (1) ACD
Solubility Molar 4.6 x 10-7 mol/L pH 4; Heerkulka: 25 °C (1) ACD
Solubility Molar 4.6 x 10-7 mol/L pH 5; Heerkulka: 25 °C (1) ACD
Solubility Molar 4.6 x 10-7 mol/L pH 6; Heerkulka: 25 °C (1) ACD
Solubility Molar 4.6 x 10-7 mol/L pH 7; Heerkulka: 25 °C (1) ACD
Solubility Molar 5.2 x 10-7 mol/L pH 8; Heerkulka: 25 °C (1) ACD
Solubility Molar 1.1 x 10-6 mol/L pH 9; Heerkulka: 25 °C (1) ACD
Solubility Molar 5.8 x 10-6 mol/L pH 10; Heerkulka: 25 °C (1) ACD

 

Hanti Qiimaha Xaalad Xigasho
Solubility Molar 4.6 x 10-7 mol/L Biyaha aan la daboolin pH 6.99; Heerkulka: 25 °C (1) ACD
Miisaanka Molecular 669.72    
pKa 9.16±0.20 Heerkulka ugu acidic badan: 25 °C (1) ACD
pKa 1.73±0.10 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)

Cufnaanta

Hanti Qiimaha Xaalad Xigasho
Cufnaanta 1.35±0.1 g/cm3 Heerkulka: 20 °C; Riix: 760 Torr (1) ACD
Mugga Molar 494.4 ± 7.0 cm3 / mol Heerkulka: 20 °C; Riix: 760 Torr (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 12   (1) ACD
H Aqbalayaasha 13   (1) ACD
H Deeq-bixiyayaasha 3   (1) ACD
Ku-deeqaha/Aqbalka Wadarta 16   (1) ACD
logP 4.763 ± 0.722 Heerkulka: 25 °C (1) ACD
Miisaanka Molecular 669.72    

(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

Xaalad

Xigasho
Aagga dusha sare ee Polar 155 A2 (1) ACD

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

Spectra la saadaaliyay

Spectra waa la heli karaa
1H NMR
13C NMR


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