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

bidhaa

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

Taarifa za Msingi:


Maelezo ya Bidhaa

Lebo za Bidhaa

Tabia za kimwili

Sifa Muhimu za Kimwili Thamani Hali
Uzito wa Masi 669.72 -
Msongamano (Uliotabiriwa) 1.35±0.1 g/cm3 Joto: 20 ° C; Bonyeza: 760 Torr
pKa (Iliyotabiriwa) 9.16±0.20 Halijoto ya Asidi Zaidi: 25 °C

Majina Mengine na Vitambulisho

TABASAMU za Kikanuni 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
Isomeric TABASAMU
C(OC[C@H]1O[C@H]([C@H](OC)[C@@H]1O)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/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
Ufunguo wa InChi
ISQLJOGRNUQHJX-WIFIACMTSA-N
1 Jina Lingine la Dawa hii
5′-O-[Bis(4-methoxyphenyl)phenylmethyl]-2′-O-methyl-N-(2-methyl-1-oxopropyl)guanosine (ACI)

Mali Zilizotabiriwa

Mali zinazopatikana
Kibiolojia
Kemikali
Msongamano
Lipinski
Kuhusiana na Muundo

Kibiolojia

Mali Thamani Hali Chanzo
Kipengele cha Mkusanyiko wa Kibiolojia 797 pH 1; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 2030 pH 2; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 2400 pH 3; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 2450 pH 4; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 2450 pH 5; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 2450 pH 6; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 2420 pH 7; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 2170 pH 8; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 1070 pH 9; Joto: 25 °C (1) ACD
Kipengele cha Mkusanyiko wa Kibiolojia 195 pH 10; Joto: 25 °C (1) ACD

(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)

Kemikali

Mali Thamani Hali Chanzo
Koc 3020 pH 1; Joto: 25 °C (1) ACD
Koc 7680 pH 2; Joto: 25 °C (1) ACD
Koc 9100 pH 3; Joto: 25 °C (1) ACD
Koc 9270 pH 4; Joto: 25 °C (1) ACD
Koc 9290 pH 5; Joto: 25 °C (1) ACD
Koc 9280 pH 6; Joto: 25 °C (1) ACD
Koc 9170 pH 7; Joto: 25 °C (1) ACD
Koc 8220 pH 8; Joto: 25 °C (1) ACD
Koc 4050 pH 9; Joto: 25 °C (1) ACD
Koc 737 pH 10; Joto: 25 °C (1) ACD
logD 4.27 pH 1; Joto: 25 °C (1) ACD
logD 4.68 pH 2; Joto: 25 °C (1) ACD

 

Mali Thamani Hali Chanzo
logD 4.75 pH 3; Joto: 25 °C (1) ACD
logD 4.76 pH 4; Joto: 25 °C (1) ACD
logD 4.76 pH 5; Joto: 25 °C (1) ACD
logD 4.76 pH 6; Joto: 25 °C (1) ACD
logD 4.76 pH 7; Joto: 25 °C (1) ACD
logD 4.71 pH 8; Joto: 25 °C (1) ACD
logD 4.40 pH 9; Joto: 25 °C (1) ACD
logD 3.66 pH 10; Joto: 25 °C (1) ACD
logP 4.763±0.722 Joto: 25 °C (1) ACD
Umumunyifu wa Ndani wa Misa 3.1 x 10-4 g/L Joto: 25 °C (1) ACD
Umumunyifu wa Misa 9.4 x 10-4 g/L pH 1; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 3.7 x 10-4 g/L pH 2; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 3.1 x 10-4 g/L pH 3; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 3.1 x 10-4 g/L pH 4; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 3.1 x 10-4 g/L pH 5; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 3.1 x 10-4 g/L pH 6; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 3.1 x 10-4 g/L pH 7; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 3.5 x 10-4 g/L pH 8; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 7.4 x 10-4 g/L pH 9; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 3.9 x 10-3 g/L pH 10; Joto: 25 °C (1) ACD
Umumunyifu wa Misa 3.1 x 10-4 g/L Maji yasio na buffered pH 6.99; Joto: 25 °C (1) ACD
Umumunyifu wa Ndani wa Molar 4.6 x 10-7 mol/L Joto: 25 °C (1) ACD
Umumunyifu wa Molar 1.4 x 10-6 mol/L pH 1; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 5.5 x 10-7 mol/L pH 2; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 4.7 x 10-7 mol/L pH 3; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 4.6 x 10-7 mol/L pH 4; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 4.6 x 10-7 mol/L pH 5; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 4.6 x 10-7 mol/L pH 6; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 4.6 x 10-7 mol/L pH 7; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 5.2 x 10-7 mol/L pH 8; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 1.1 x 10-6 mol/L pH 9; Joto: 25 °C (1) ACD
Umumunyifu wa Molar 5.8 x 10-6 mol/L pH 10; Joto: 25 °C (1) ACD

 

Mali Thamani Hali Chanzo
Umumunyifu wa Molar 4.6 x 10-7 mol/L Maji yasio na buffered pH 6.99; Joto: 25 °C (1) ACD
Uzito wa Masi 669.72    
pKa 9.16±0.20 Halijoto ya Asidi Zaidi: 25 °C (1) ACD
pKa 1.73±0.10 Joto la Msingi Zaidi: 25 °C (1) ACD

(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)

Msongamano

Mali Thamani Hali Chanzo
Msongamano 1.35±0.1 g/cm3 Joto: 20 ° C; Bonyeza: 760 Torr (1) ACD
Kiasi cha Molar 494.4±7.0 cm3/mol Joto: 20 ° C; Bonyeza: 760 Torr (1) ACD

(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Mali Thamani Hali Chanzo
Vifungo vinavyoweza kuzungushwa kwa Uhuru 12   (1) ACD
H Wapokeaji 13   (1) ACD
H Wafadhili 3   (1) ACD
H Jumla ya Mfadhili/Mpokeaji 16   (1) ACD
logP 4.763±0.722 Joto: 25 °C (1) ACD
Uzito wa Masi 669.72    

(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)

Kuhusiana na Muundo

Mali Thamani

Hali

Chanzo
Eneo la Uso wa Polar 155 A2 (1) ACD

(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)

Spectra iliyotabiriwa

Spectra inapatikana
1H NMR
13C NMR


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