1-oxo-N-{[4-(trifluoromethoxy)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Chemical Structure Depiction of
1-oxo-N-{[4-(trifluoromethoxy)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
1-oxo-N-{[4-(trifluoromethoxy)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P896-0146 |
| Compound Name: | 1-oxo-N-{[4-(trifluoromethoxy)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide |
| Molecular Weight: | 403.38 |
| Molecular Formula: | C16 H16 F3 N3 O4 S |
| Smiles: | C1CNC(c2cc(cn2C1)S(NCc1ccc(cc1)OC(F)(F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2643 |
| logD: | 2.2641 |
| logSw: | -2.886 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.658 |
| InChI Key: | XTZSCVWPNBVTSQ-UHFFFAOYSA-N |