N-methyl-N-[(4-methyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)methyl]benzenesulfonamide
Chemical Structure Depiction of
N-methyl-N-[(4-methyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)methyl]benzenesulfonamide
N-methyl-N-[(4-methyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)methyl]benzenesulfonamide
Compound characteristics
| Compound ID: | 8014-3044 |
| Compound Name: | N-methyl-N-[(4-methyl-5-sulfanyl-4H-1,2,4-triazol-3-yl)methyl]benzenesulfonamide |
| Molecular Weight: | 298.38 |
| Molecular Formula: | C11 H14 N4 O2 S2 |
| Smiles: | CN(Cc1nnc(n1C)S)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4877 |
| logD: | 0.0633 |
| logSw: | -2.0824 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.608 |
| InChI Key: | YRPZOOJDSAEOIR-UHFFFAOYSA-N |