1-oxo-N-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Chemical Structure Depiction of
1-oxo-N-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
1-oxo-N-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P896-0120 |
| Compound Name: | 1-oxo-N-{[3-(trifluoromethyl)phenyl]methyl}-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide |
| Molecular Weight: | 387.38 |
| Molecular Formula: | C16 H16 F3 N3 O3 S |
| Smiles: | C1CNC(c2cc(cn2C1)S(NCc1cccc(c1)C(F)(F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8717 |
| logD: | 1.8713 |
| logSw: | -2.543 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.721 |
| InChI Key: | ZJVVXLATFLLRDP-UHFFFAOYSA-N |