Vebicorvir
6,11,11-trioxo-N-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]-5H-benzo[b][1,4]benzothiazepine-3-carboxamide
Molecular Identity
Vebicorvir
6,11,11-trioxo-N-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]-5H-benzo[b][1,4]benzothiazepine-3-carboxamide
PubChem CID: 139394142
2D Structure
Properties
C19H12F3N3O4S2
Molecular Formula
467.40
Molecular Weight
g/mol
467.0221
Exact Mass
Da
2.4
XLogP
Drug-like (Lipinski: < 5)
142
TPSA
May have limited oral absorption
2
H-Bond Donors
9
H-Bond Acceptors
817
Complexity
SMILES
Canonical SMILES
SMILES: C1=CC=C2C(=C1)C(=O)NC3=C(S2(=O)=O)C=CC(=C3)C(=O)NCC4=CN=C(S4)C(F)(F)FIsomeric SMILES
SMILES: C1=CC=C2C(=C1)C(=O)NC3=C(S2(=O)=O)C=CC(=C3)C(=O)NCC4=CN=C(S4)C(F)(F)FSynonyms(20)
VebicorvirABI-H0731Vebicorvir [INN]Vebicorvir [USAN]16F6055SMGVEBICORVIR [WHO-DD]UNII-16F6055SMGDibenzo(b,F)(1,4)thiazepine-8-carboxamide, 10,11-dihydro-11-oxo-N-((2-(trifluoromethyl)-5-thiazolyl)methyl)-, 5,5-dioxideRefChem:1938815,5,11-TRIOXO-N-((2-(TRIFLUOROMETHYL)-1,3-THIAZOL-5-YL)METHYL)-10,11-DIHYDRO-5H-5.LAMBDA.6-DIBENZO(B,F)(1,4)THIAZEPINE-8-CARBOXAMIDE5,5,11-TRIOXO-N-((2-(TRIFLUOROMETHYL)-1,3-THIAZOL-5-YL)METHYL)-10,11-DIHYDRO-5H-5LAMBDA6-DIBENZO(B,F)(1,4)THIAZEPINE-8-CARBOXAMIDE2090064-66-511-Oxo-N-((2-(trifluoromethyl)thiazol-5-yl)methyl)-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide 5,5-dioxide6,11,11-trioxo-N-[[2-(trifluoromethyl)-1,3-thiazol-5-yl]methyl]-5H-benzo[b][1,4]benzothiazepine-3-carboxamide6,11,11-trioxo-N-[[2-(trifluoromethyl)thiazol-5-yl]methyl]-5H-benzo[b][1,4]benzothiazepine-3-carboxamide
Data from PubChem (NCBI)
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