N-(3-chloro-4-methoxyphenyl)-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-methoxyphenyl)-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
N-(3-chloro-4-methoxyphenyl)-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P896-0028 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide |
| Molecular Weight: | 369.82 |
| Molecular Formula: | C15 H16 Cl N3 O4 S |
| Smiles: | COc1ccc(cc1[Cl])NS(c1cc2C(NCCCn2c1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6225 |
| logD: | 1.4445 |
| logSw: | -2.8894 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.243 |
| InChI Key: | JMARLRMEORNJBJ-UHFFFAOYSA-N |