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Chemical structure of MK-5172

GC18004

MK-5172

Also known as (1R,18R,20R,24S,27S)-24-tert-butyl-N-[(1R,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenylcyclopropyl]-7-methoxy-22,25-dioxo-2,21-dioxa-4,11,23,26-tetrazapentacyclo[24.2.1.03,12.05,10.018,20]nonacosa-3,5(10),6,8,11-pentaene-27-carboxamide

An NS3/4A protease inhibitor

ChemicalCAS1350514-68-9MW766.9FormulaC38H50N6O9S
CAS number
1350514-68-9
Molecular weight
766.9
Formula
C38H50N6O9S
Solubility
≥ 38·35 mg/mL in DMSO, ≥ 24 mg/mL in EtOH with ultrasonic and warming
InChIKey
OBMNJSNZOWALQB-NCQNOWPTSA-N
Catalogue number
GC18004
Brand
GLPBIO
Computed properties PubChem CID 44603531 · XLogP 4.7 · TPSA 204 Ų · H-bond donors 3
XLogP
4.7
TPSA
204 Ų
H-bond donors
3
H-bond acceptors
11
Rotatable bonds
8
Heavy atoms
54

SMILES CC(C)(C)[C@H]1C(=O)N2C[C@@H](C[C@H]2C(=O)N[C@@]3(C[C@H]3C=C)C(=O)NS(=O)(=O)C4CC4)OC5=NC6=C(C=CC(=C6)OC)N=C5CCCCC[C@@H]7C[C@H]7OC(=O)N1

Computed descriptors from PubChem (CID 44603531), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

Lead time
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Pricing
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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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