1-{3-[7-(cyclopropanecarbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}-2-(4-fluorophenoxy)ethan-1-one
Chemical Structure Depiction of
1-{3-[7-(cyclopropanecarbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}-2-(4-fluorophenoxy)ethan-1-one
1-{3-[7-(cyclopropanecarbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}-2-(4-fluorophenoxy)ethan-1-one
Compound characteristics
| Compound ID: | S585-0457 |
| Compound Name: | 1-{3-[7-(cyclopropanecarbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}-2-(4-fluorophenoxy)ethan-1-one |
| Molecular Weight: | 427.48 |
| Molecular Formula: | C22 H26 F N5 O3 |
| Smiles: | C1CC(CN(C1)C(COc1ccc(cc1)F)=O)c1nnc2CN(CCn12)C(C1CC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0294 |
| logD: | 1.0293 |
| logSw: | -1.8655 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.398 |
| InChI Key: | NJKAACJEYXPUJO-INIZCTEOSA-N |