N-(3,4-dimethylphenyl)-3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidine-1-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidine-1-carboxamide
N-(3,4-dimethylphenyl)-3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | P936-3005 |
| Compound Name: | N-(3,4-dimethylphenyl)-3-{[4-(propan-2-yl)-4H-1,2,4-triazol-3-yl]methyl}pyrrolidine-1-carboxamide |
| Molecular Weight: | 341.45 |
| Molecular Formula: | C19 H27 N5 O |
| Smiles: | CC(C)n1cnnc1CC1CCN(C1)C(Nc1ccc(C)c(C)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.327 |
| logD: | 3.3255 |
| logSw: | -3.4167 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.131 |
| InChI Key: | CNHYCQIRJIVRQE-INIZCTEOSA-N |