N-(3-chloro-4-fluorophenyl)-2-ethyl-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-ethyl-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
N-(3-chloro-4-fluorophenyl)-2-ethyl-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P896-0631 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-ethyl-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide |
| Molecular Weight: | 385.84 |
| Molecular Formula: | C16 H17 Cl F N3 O3 S |
| Smiles: | CCN1CCCn2cc(cc2C1=O)S(Nc1ccc(c(c1)[Cl])F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6172 |
| logD: | 1.4118 |
| logSw: | -3.371 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.955 |
| InChI Key: | QDDDTGZCQORVMV-UHFFFAOYSA-N |