Pomotrelvir
7-chloro-N-[(2S)-1-[[(1S)-1-cyano-2-[(3S)-2-oxopiperidin-3-yl]ethyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-1H-indole-2-carboxamide
Molecular Identity
Pomotrelvir
7-chloro-N-[(2S)-1-[[(1S)-1-cyano-2-[(3S)-2-oxopiperidin-3-yl]ethyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-1H-indole-2-carboxamide
PubChem CID: 162396309
2D Structure
Properties
C23H26ClN5O3
Molecular Formula
455.90
Molecular Weight
g/mol
455.1724
Exact Mass
Da
3.1
XLogP
Drug-like (Lipinski: < 5)
127
TPSA
Good oral absorption (< 140 A²)
4
H-Bond Donors
4
H-Bond Acceptors
779
Complexity
SMILES
Canonical SMILES
SMILES: C1CC(C(=O)NC1)CC(C#N)NC(=O)C(CC2CC2)NC(=O)C3=CC4=C(N3)C(=CC=C4)ClIsomeric SMILES
SMILES: C1C[C@H](C(=O)NC1)C[C@@H](C#N)NC(=O)[C@H](CC2CC2)NC(=O)C3=CC4=C(N3)C(=CC=C4)ClSynonyms(20)
Pomotrelvir2713437-86-4PBI-04516XHD59349RPBI 0451PBI04517-Chloro-N-((2S)-1-(((1S)-1-cyano-2-((3S)-2-oxopiperidin-3-yl)ethyl)amino)-3-cyclopropyl-1-oxopropan-2-yl)-1H-indole-2-carboxamide7-chloro-N-[(2S)-1-[[(1S)-1-cyano-2-[(3S)-2-oxopiperidin-3-yl]ethyl]amino]-3-cyclopropyl-1-oxopropan-2-yl]-1H-indole-2-carboxamideRefChem:929868Pomotrelvir [INN]UNII-6XHD59349RPBI 0451 [WHO-DD]7-Chloro-N-((S)-1-(((S)-1-cyano-2-((S)-2-oxopiperidin-3-yl)ethyl)amino)-3-cyclopropyl-1-oxopropan-2-yl)-1H-indole-2-carboxamide1H-Indole-2-carboxamide, 7-chloro-N-((1S)-2-(((1S)-1-cyano-2-((3S)-2-oxo-3-piperidinyl)ethyl)amino)-1-(cyclopropylmethyl)-2-oxoethyl)-1H-Indole-2-carboxamide, 7-chloro-N-[(1S)-2-[[(1S)-1-cyano-2-[(3S)-2-oxo-3-piperidinyl]ethyl]amino]-1-(cyclopropylmethyl)-2-oxoethyl]-
Data from PubChem (NCBI)
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