N-[(1-benzyl-1H-pyrrol-2-yl)methyl]-3,4-dimethylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[(1-benzyl-1H-pyrrol-2-yl)methyl]-3,4-dimethylbenzene-1-sulfonamide
N-[(1-benzyl-1H-pyrrol-2-yl)methyl]-3,4-dimethylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | G529-0095 |
| Compound Name: | N-[(1-benzyl-1H-pyrrol-2-yl)methyl]-3,4-dimethylbenzene-1-sulfonamide |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C20 H22 N2 O2 S |
| Smiles: | Cc1ccc(cc1C)S(NCc1cccn1Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5969 |
| logD: | 4.596 |
| logSw: | -4.3903 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.067 |
| InChI Key: | XIEGCYOABCYKPY-UHFFFAOYSA-N |