2-ethyl-N-[(4-methylphenyl)methyl]-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Chemical Structure Depiction of
2-ethyl-N-[(4-methylphenyl)methyl]-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
2-ethyl-N-[(4-methylphenyl)methyl]-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide
Compound characteristics
| Compound ID: | P896-0649 |
| Compound Name: | 2-ethyl-N-[(4-methylphenyl)methyl]-1-oxo-2,3,4,5-tetrahydro-1H-pyrrolo[1,2-a][1,4]diazepine-8-sulfonamide |
| Molecular Weight: | 361.46 |
| Molecular Formula: | C18 H23 N3 O3 S |
| Smiles: | CCN1CCCn2cc(cc2C1=O)S(NCc1ccc(C)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2716 |
| logD: | 2.2712 |
| logSw: | -2.8458 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.064 |
| InChI Key: | KMPJQEDVQVXMIX-UHFFFAOYSA-N |