YMCAVGXTSCNFDE-BBACVFHCSA-N structure, CAS 1256390-53-0

YMCAVGXTSCNFDE-BBACVFHCSA-N

CAS Number1256390-53-0

SynonymsMFCD28963895; GSK-2336805

Molecular FormulaC42H52N8O8

Molecular Weight796.91

Purity

Density1.4±0.1 g/cm3

Boiling Point1115.3±65.0 °C at 760 mmHg

Melting Point

Flash Point

Appearance

EINECS

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Symbol

Signal Word

Cat. No.: 2A-2187141 Purity:
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Quality Control of [ 1256390-53-0 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number1256390-53-0
Catalog No.2A-2187141
Chinese NameGSK2236805
SynonymsMFCD28963895; GSK-2336805
Molecular FormulaC42H52N8O8
Molecular Weight796.91
Density1.4±0.1 g/cm3
Boiling Point1115.3±65.0 °C at 760 mmHg
ApplicationGSK2236805 is a potent inhibitor of hepatitis C virus, with pEC50 values ​​of 10.4 and 11.1 for HCV genotype 1a (gt1a) and gt1b respectively [1].
PubChem ID136350084
SMILESCOC(=O)NC(C(=O)N1CCCC1c1ncc(-c2ccc(-c3ccc(-c4cnc(C5CC6(CN5C(=O)C(NC(=O)OC)C(C)C)OCCO6)[nH]4)cc3)cc2)[nH]1)C(C)C
InChIInChI=1S/C42H52N8O8/c1-24(2)34(47-40(53)55-5)38(51)49-17-7-8-32(49)36-43-21-30(45-36)28-13-9-26(10-14-28)27-11-15-29(16-12-27)31-22-44-37(46-31)33-20-42(57-18-19-58-42)23-50(33)39(52)35(25(3)4)48-41(54)56-6/h9-16,21-22,24-25,32-35H,7-8,17-20,23H2,1-6H3,(H,43,45)(H,44,46)(H,47,53)(H,48,54)/t32-,33-,34-,35-/m0/s1
InChI KeyYMCAVGXTSCNFDE-BBACVFHCSA-N
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