N-({4-methyl-5-[(2-phenoxyethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)-N-(4-methylphenyl)methanesulfonamide
Chemical Structure Depiction of
N-({4-methyl-5-[(2-phenoxyethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)-N-(4-methylphenyl)methanesulfonamide
N-({4-methyl-5-[(2-phenoxyethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)-N-(4-methylphenyl)methanesulfonamide
Compound characteristics
| Compound ID: | D580-1766 |
| Compound Name: | N-({4-methyl-5-[(2-phenoxyethyl)sulfanyl]-4H-1,2,4-triazol-3-yl}methyl)-N-(4-methylphenyl)methanesulfonamide |
| Molecular Weight: | 432.56 |
| Molecular Formula: | C20 H24 N4 O3 S2 |
| Smiles: | Cc1ccc(cc1)N(Cc1nnc(n1C)SCCOc1ccccc1)S(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8239 |
| logD: | 2.8239 |
| logSw: | -3.2415 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 65.034 |
| InChI Key: | LWABFGLQGBJPBZ-UHFFFAOYSA-N |