Polmacoxib
4-[3-(3-fluorophenyl)-5,5-dimethyl-4-oxofuran-2-yl]benzenesulfonamide
Molecular Identity
Polmacoxib
4-[3-(3-fluorophenyl)-5,5-dimethyl-4-oxofuran-2-yl]benzenesulfonamide
PubChem CID: 9841854
2D Structure
Properties
C18H16FNO4S
Molecular Formula
361.40
Molecular Weight
g/mol
361.0784
Exact Mass
Da
2.6
XLogP
Drug-like (Lipinski: < 5)
94.8
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
6
H-Bond Acceptors
672
Complexity
SMILES
Canonical SMILES
SMILES: CC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC(=CC=C3)F)CIsomeric SMILES
SMILES: CC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC(=CC=C3)F)CSynonyms(20)
Polmacoxib301692-76-2CG100649CG-100649IJ34D6YPAO4-[3-(3-fluorophenyl)-5,5-dimethyl-4-oxofuran-2-yl]benzenesulfonamideDTXSID9010293894-(3-(3-Fluorophenyl)-5,5-dimethyl-4-oxo-4,5-dihydrofuran-2-yl)-benzenesulfonamideBenzenesulfonamide, 4-(3-(3-fluorophenyl)-4,5-dihydro-5,5-dimethyl-4-oxo-2-furanyl)-polmacoxibum4-(3-(3-fluorophenyl)-5,5-dimethyl-4-oxofuran-2-yl)benzenesulfonamide4-[3-(3-Fluorophenyl)-5,5-dimethyl-4-oxo-4,5-dihydrofuran-2-yl]-benzenesulfonamideRefChem:863919M01AH07DTXCID401514652
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Polmacoxib
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