1-{3-[7-(cyclopropanecarbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}-3-phenylpropan-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}-3-phenylpropan-1-one
1-{3-[7-(cyclopropanecarbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}-3-phenylpropan-1-one
Compound characteristics
| Compound ID: | S585-0484 |
| Compound Name: | 1-{3-[7-(cyclopropanecarbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}-3-phenylpropan-1-one |
| Molecular Weight: | 407.51 |
| Molecular Formula: | C23 H29 N5 O2 |
| Smiles: | C1CC(CN(C1)C(CCc1ccccc1)=O)c1nnc2CN(CCn12)C(C1CC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8072 |
| logD: | 1.8071 |
| logSw: | -1.9561 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.899 |
| InChI Key: | MTOYAAOEJRSGHI-IBGZPJMESA-N |