Presatovir
N-[2-[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidine-1-carbonyl]-4-chlorophenyl]methanesulfonamide
Molecular Identity
Presatovir
N-[2-[(2S)-2-[5-[(3S)-3-aminopyrrolidin-1-yl]-6-methylpyrazolo[1,5-a]pyrimidin-2-yl]piperidine-1-carbonyl]-4-chlorophenyl]methanesulfonamide
PubChem CID: 58029842
2D Structure
Properties
C24H30ClN7O3S
Molecular Formula
532.10
Molecular Weight
g/mol
531.1819
Exact Mass
Da
2.4
XLogP
Drug-like (Lipinski: < 5)
134
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
8
H-Bond Acceptors
905
Complexity
SMILES
Canonical SMILES
SMILES: CC1=CN2C(=CC(=N2)C3CCCCN3C(=O)C4=C(C=CC(=C4)Cl)NS(=O)(=O)C)N=C1N5CCC(C5)NIsomeric SMILES
SMILES: CC1=CN2C(=CC(=N2)[C@@H]3CCCCN3C(=O)C4=C(C=CC(=C4)Cl)NS(=O)(=O)C)N=C1N5CC[C@@H](C5)NSynonyms(20)
Presatovir1353625-73-6GS-5806GS 58069628AJ27JAGS5806N-(2-((S)-2-(5-((S)-3-aminopyrrolidin-1-yl)-6-methylpyrazolo[1,5-a]pyrimidin-2-yl)piperidine-1-carbonyl)-4-chlorophenyl)methanesulfonamideMethanesulfonamide, N-(2-(((2S)-2-(5-((3S)-3-amino-1-pyrrolidinyl)-6-methylpyrazolo(1,5-a)pyrimidin-2-yl)-1-piperidinyl)carbonyl)-4-chlorophenyl)-DTXSID201028097N-(2-(((2S)-2-(5-((3S)-3-amino-1-pyrrolidinyl)-6-methylpyrazolo(1,5-A)pyrimidin-2-yl)-1-piperidinyl)carbonyl)-4-chlorophenyl)-methanesulfonamidepresatovirumN-(2-((S)-2-(5-((S)-3-aminopyrrolidin-1-yl)-6-methylpyrazolo(1,5-a)pyrimidin-2-yl)piperidine-1-carbonyl)-4-chlorophenyl)methanesulfonamideRefChem:929966DTXCID001513664Respiratory Syncytial Virus Fusion Inhibitor GS-5806
Data from PubChem (NCBI)
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