MK5172 structure, CAS 1350514-68-9

MK5172

CAS Number1350514-68-9

SynonymsUNII-8YE81R1X1J; MK-5172; CS-1374; grazoprevir; MK5172

Molecular FormulaC38H50O9N6S1

Molecular Weight766.92

Purity

Density1.4±0.1 g/cm3

Boiling Point

Melting Point

Flash Point

Appearancepowder

EINECS

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Symbol

Signal Word

Cat. No.: 2A-3186647 Purity:
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Quality Control of [ 1350514-68-9 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number1350514-68-9
Catalog No.2A-3186647
Chinese Name格拉瑞韦
SynonymsUNII-8YE81R1X1J; MK-5172; CS-1374; grazoprevir; MK5172
Molecular FormulaC38H50O9N6S1
Molecular Weight766.92
Density1.4±0.1 g/cm3
Appearancepowder
Storage Condition-20℃
ApplicationGrazoprevir (MK-5172) is a selective hepatitis C virus NS3/4a protease inhibitor with Ki of 0.01 nM, 0.01 nM, 0.08 nM, 0.15 nM and 0.90 nM for gt1b, gt1a, gt2a, gt2b and gt3a respectively.
PubChem ID85332785
MDL NumberMFCD25976700
SMILESC=CC1CC1(NC(=O)C1CC2CN1C(=O)C(C(C)(C)C)NC(=O)OC1CC1CCCCCc1nc3ccc(OC)cc3nc1O2)C(=O)NS(=O)(=O)C1CC1
InChIInChI=1S/C38H50N6O9S/c1-6-22-19-38(22,35(47)43-54(49,50)25-13-14-25)42-32(45)29-18-24-20-44(29)34(46)31(37(2,3)4)41-36(48)53-30-16-21(30)10-8-7-9-11-27-33(52-24)40-28-17-23(51-5)12-15-26(28)39-27/h6,12,15,17,21-22,24-25,29-31H,1,7-11,13-14,16,18-20H2,2-5H3,(H,41,48)(H,42,45)(H,43,47)/t21-,22-,24-,29+,30-,31-,38-/m1/s1
InChI KeyOBMNJSNZOWALQB-NCQNOWPTSA-N
Transport InfoProduct name: MK-5172
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