1-{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}-4-phenylbutan-1-one
Chemical Structure Depiction of
1-{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}-4-phenylbutan-1-one
1-{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}-4-phenylbutan-1-one
Compound characteristics
| Compound ID: | SD73-0521 |
| Compound Name: | 1-{2-[2-(4-benzyl-4H-1,2,4-triazol-3-yl)ethyl]pyrrolidin-1-yl}-4-phenylbutan-1-one |
| Molecular Weight: | 402.54 |
| Molecular Formula: | C25 H30 N4 O |
| Smiles: | C(CC(N1CCCC1CCc1nncn1Cc1ccccc1)=O)Cc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9962 |
| logD: | 3.9962 |
| logSw: | -4.1988 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.432 |
| InChI Key: | RBBFWQSKNMMVBV-HSZRJFAPSA-N |