N-(3,5-dimethoxyphenyl)-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Chemical Structure Depiction of
N-(3,5-dimethoxyphenyl)-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
N-(3,5-dimethoxyphenyl)-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P896-0059 |
| Compound Name: | N-(3,5-dimethoxyphenyl)-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide |
| Molecular Weight: | 365.41 |
| Molecular Formula: | C16 H19 N3 O5 S |
| Smiles: | COc1cc(cc(c1)OC)NS(c1cc2C(NCCCn2c1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1116 |
| logD: | 1.0018 |
| logSw: | -2.2915 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.7 |
| InChI Key: | ISAPCKDUEJHTCL-UHFFFAOYSA-N |