N-benzyl-3-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidine-1-carboxamide
Chemical Structure Depiction of
N-benzyl-3-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidine-1-carboxamide
N-benzyl-3-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | P936-2729 |
| Compound Name: | N-benzyl-3-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidine-1-carboxamide |
| Molecular Weight: | 313.4 |
| Molecular Formula: | C17 H23 N5 O |
| Smiles: | CCn1cnnc1CC1CCN(C1)C(NCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3725 |
| logD: | 1.372 |
| logSw: | -1.8196 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.386 |
| InChI Key: | IPWOJTBFKZJUBF-HNNXBMFYSA-N |