3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-N-(2-ethoxyphenyl)pyrrolidine-1-carboxamide
Chemical Structure Depiction of
3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-N-(2-ethoxyphenyl)pyrrolidine-1-carboxamide
3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-N-(2-ethoxyphenyl)pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | P936-3535 |
| Compound Name: | 3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]-N-(2-ethoxyphenyl)pyrrolidine-1-carboxamide |
| Molecular Weight: | 405.5 |
| Molecular Formula: | C23 H27 N5 O2 |
| Smiles: | CCOc1ccccc1NC(N1CCC(Cc2nncn2Cc2ccccc2)C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5397 |
| logD: | 3.5396 |
| logSw: | -3.5828 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.58 |
| InChI Key: | CJNSQUHNPKZQAJ-IBGZPJMESA-N |