Imrecoxib
4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-1-propyl-2H-pyrrol-5-one
Molecular Identity
Imrecoxib
4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-1-propyl-2H-pyrrol-5-one
PubChem CID: 11682175
2D Structure
Properties
C21H23NO3S
Molecular Formula
369.50
Molecular Weight
g/mol
369.1399
Exact Mass
Da
3.1
XLogP
Drug-like (Lipinski: < 5)
62.8
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
3
H-Bond Acceptors
645
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Imrecoxib395683-14-4BAP-909SGW6W5758V2H-Pyrrol-2-one, 1,5-dihydro-3-(4-methylphenyl)-4-(4-(methylsulfonyl)phenyl)-1-propyl-RefChem:1480544-(4-methanesulfonylphenyl)-3-(4-methylphenyl)-1-propyl-2,5-dihydro-1H-pyrrol-2-oneUNII-SGW6W5758VCHEMBL504535Imrecoxib (Standard)4-(4-methylphenyl)-3-(4-methylsulfonylphenyl)-1-propyl-2H-pyrrol-5-oneIMRECOXIB [WHO-DD]orb1308200SCHEMBL3034253BDBM50293282
Data from PubChem (NCBI)
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Drug Network
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