N-[2-(5-benzyl-1H-1,2,4-triazol-3-yl)ethyl]-3-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(5-benzyl-1H-1,2,4-triazol-3-yl)ethyl]-3-methylbenzene-1-sulfonamide
N-[2-(5-benzyl-1H-1,2,4-triazol-3-yl)ethyl]-3-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | G718-1520 |
| Compound Name: | N-[2-(5-benzyl-1H-1,2,4-triazol-3-yl)ethyl]-3-methylbenzene-1-sulfonamide |
| Molecular Weight: | 356.44 |
| Molecular Formula: | C18 H20 N4 O2 S |
| Smiles: | Cc1cccc(c1)S(NCCc1nc(Cc2ccccc2)[nH]n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4764 |
| logD: | 3.475 |
| logSw: | -3.7806 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.604 |
| InChI Key: | BCNNEHCKLFDZSC-UHFFFAOYSA-N |