1-{3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}-2-phenylethan-1-one
Chemical Structure Depiction of
1-{3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}-2-phenylethan-1-one
1-{3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}-2-phenylethan-1-one
Compound characteristics
| Compound ID: | P936-3430 |
| Compound Name: | 1-{3-[(4-benzyl-4H-1,2,4-triazol-3-yl)methyl]pyrrolidin-1-yl}-2-phenylethan-1-one |
| Molecular Weight: | 360.46 |
| Molecular Formula: | C22 H24 N4 O |
| Smiles: | C1CN(CC1Cc1nncn1Cc1ccccc1)C(Cc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8817 |
| logD: | 2.8817 |
| logSw: | -3.1236 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.72 |
| InChI Key: | FFAJFDBRIXBJTA-FQEVSTJZSA-N |