N-(3,4-dimethylphenyl)-3-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidine-1-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-3-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidine-1-carboxamide
N-(3,4-dimethylphenyl)-3-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | P937-4163 |
| Compound Name: | N-(3,4-dimethylphenyl)-3-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidine-1-carboxamide |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C22 H25 N5 O |
| Smiles: | Cc1ccc(cc1C)NC(N1CCC(Cc2nnc(c3ccccc3)[nH]2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4075 |
| logD: | 4.372 |
| logSw: | -4.3076 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.511 |
| InChI Key: | IUMKVKGRXXDCLU-KRWDZBQOSA-N |