N-(2,5-dimethoxyphenyl)-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
N-(2,5-dimethoxyphenyl)-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P896-0079 |
| Compound Name: | N-(2,5-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: | COc1ccc(c(c1)NS(c1cc2C(NCCCn2c1)=O)(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 0.9664 |
| logD: | 0.7007 |
| logSw: | -2.3818 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.089 |
| InChI Key: | KTBTZDODEPBJOO-UHFFFAOYSA-N |