N-benzyl-3-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidine-1-carboxamide
Chemical Structure Depiction of
N-benzyl-3-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidine-1-carboxamide
N-benzyl-3-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | P937-4158 |
| Compound Name: | N-benzyl-3-[(5-phenyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidine-1-carboxamide |
| Molecular Weight: | 361.45 |
| Molecular Formula: | C21 H23 N5 O |
| Smiles: | C1CN(CC1Cc1nnc(c2ccccc2)[nH]1)C(NCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0476 |
| logD: | 3.0121 |
| logSw: | -3.2439 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.833 |
| InChI Key: | GHYNYOHZUKJREY-KRWDZBQOSA-N |