N-[3-(1H-benzotriazol-1-yl)-3-oxopropyl]-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[3-(1H-benzotriazol-1-yl)-3-oxopropyl]-4-methylbenzene-1-sulfonamide
N-[3-(1H-benzotriazol-1-yl)-3-oxopropyl]-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y032-4341 |
| Compound Name: | N-[3-(1H-benzotriazol-1-yl)-3-oxopropyl]-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 344.39 |
| Molecular Formula: | C16 H16 N4 O3 S |
| Smiles: | Cc1ccc(cc1)S(NCCC(n1c2ccccc2nn1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0704 |
| logD: | 2.0703 |
| logSw: | -2.7488 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.34 |
| InChI Key: | IYCUCVGZHMJKRN-UHFFFAOYSA-N |