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Chemical structure of Velpatasvir

GC19372

Velpatasvir

Also known as methyl N-[(1R)-2-[(2S,4S)-2-[5-[6-[(2S,5S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]-5-methylpyrrolidin-2-yl]-21-oxa-5,7-diazapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-1(13),2,4(8),5,9,11,14(19),15,17-nonaen-17-yl]-1H-imidazol-2-yl]-4-(methoxymethyl)pyrrolidin-1-yl]-2-oxo-1-phenylethyl]carbamate

Velpatasvir (VEL, GS-5816) is a novel pan-genotypic hepatitis C virus (HCV) nonstructural protein 5A (NS5A) inhibitor with activity against genotype 1 (GT1) to GT6 HCV replicons

ChemicalCAS1377049-84-7MW883FormulaC49H54N8O8
CAS number
1377049-84-7
Molecular weight
883
Formula
C49H54N8O8
Solubility
DMSO ： 146·66 mg/mL (166·09 mM)
InChIKey
FHCUMDQMBHQXKK-CDIODLITSA-N
Catalogue number
GC19372
Brand
GLPBIO
Computed properties PubChem CID 67683363 · XLogP 6.2 · TPSA 193 Ų · H-bond donors 4
XLogP
6.2
TPSA
193 Ų
H-bond donors
4
H-bond acceptors
10
Rotatable bonds
13
Heavy atoms
65

SMILES C[C@H]1CC[C@H](N1C(=O)[C@H](C(C)C)NC(=O)OC)C2=NC3=C(N2)C=CC4=CC5=C(C=C43)OCC6=C5C=CC(=C6)C7=CN=C(N7)[C@@H]8C[C@@H](CN8C(=O)[C@@H](C9=CC=CC=C9)NC(=O)OC)COC

Computed descriptors from PubChem (CID 67683363), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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