3,4-dimethyl-N-{[4-(3-methylphenyl)-5-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Chemical Structure Depiction of
3,4-dimethyl-N-{[4-(3-methylphenyl)-5-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
3,4-dimethyl-N-{[4-(3-methylphenyl)-5-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Compound characteristics
| Compound ID: | C592-0574 |
| Compound Name: | 3,4-dimethyl-N-{[4-(3-methylphenyl)-5-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide |
| Molecular Weight: | 492.62 |
| Molecular Formula: | C24 H24 N6 O2 S2 |
| Smiles: | Cc1cccc(c1)n1c(CNC(c2ccc(C)c(C)c2)=O)nnc1SCC(Nc1nccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2133 |
| logD: | 4.2129 |
| logSw: | -4.267 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.001 |
| InChI Key: | MBFWBCNCRCYINJ-UHFFFAOYSA-N |