N-[(2-chloro-4-fluorophenyl)methyl]-2-ethyl-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Chemical Structure Depiction of
N-[(2-chloro-4-fluorophenyl)methyl]-2-ethyl-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
N-[(2-chloro-4-fluorophenyl)methyl]-2-ethyl-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P896-0637 |
| Compound Name: | N-[(2-chloro-4-fluorophenyl)methyl]-2-ethyl-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide |
| Molecular Weight: | 399.87 |
| Molecular Formula: | C17 H19 Cl F N3 O3 S |
| Smiles: | CCN1CCCn2cc(cc2C1=O)S(NCc1ccc(cc1[Cl])F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8174 |
| logD: | 2.8169 |
| logSw: | -3.458 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.064 |
| InChI Key: | GFRMDTFBOKHOGU-UHFFFAOYSA-N |