2-{[7-(4-fluorophenyl)-6,7-dihydro-5H-imidazo[2,1-c][1,2,4]triazol-3-yl]sulfanyl}-1-(4-methylpiperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[7-(4-fluorophenyl)-6,7-dihydro-5H-imidazo[2,1-c][1,2,4]triazol-3-yl]sulfanyl}-1-(4-methylpiperidin-1-yl)ethan-1-one
2-{[7-(4-fluorophenyl)-6,7-dihydro-5H-imidazo[2,1-c][1,2,4]triazol-3-yl]sulfanyl}-1-(4-methylpiperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | F595-0282 |
| Compound Name: | 2-{[7-(4-fluorophenyl)-6,7-dihydro-5H-imidazo[2,1-c][1,2,4]triazol-3-yl]sulfanyl}-1-(4-methylpiperidin-1-yl)ethan-1-one |
| Molecular Weight: | 375.47 |
| Molecular Formula: | C18 H22 F N5 O S |
| Smiles: | CC1CCN(CC1)C(CSc1nnc2N(CCn12)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9603 |
| logD: | 2.9285 |
| logSw: | -3.2239 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.115 |
| InChI Key: | TUESTAVPIKYUFB-UHFFFAOYSA-N |