1-[3-(3-phenyl-4H-1,2,4-triazol-4-yl)pyrrolidin-1-yl]-2-(thiophen-3-yl)ethan-1-one
Chemical Structure Depiction of
1-[3-(3-phenyl-4H-1,2,4-triazol-4-yl)pyrrolidin-1-yl]-2-(thiophen-3-yl)ethan-1-one
1-[3-(3-phenyl-4H-1,2,4-triazol-4-yl)pyrrolidin-1-yl]-2-(thiophen-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | P944-2461 |
| Compound Name: | 1-[3-(3-phenyl-4H-1,2,4-triazol-4-yl)pyrrolidin-1-yl]-2-(thiophen-3-yl)ethan-1-one |
| Molecular Weight: | 338.43 |
| Molecular Formula: | C18 H18 N4 O S |
| Smiles: | C1CN(CC1n1cnnc1c1ccccc1)C(Cc1ccsc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.395 |
| logD: | 2.395 |
| logSw: | -2.3635 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.862 |
| InChI Key: | VVDYAJJRYLUTGH-UHFFFAOYSA-N |