1-[4-(7-benzoyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)piperidin-1-yl]-3-methylbutan-1-one
Chemical Structure Depiction of
1-[4-(7-benzoyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)piperidin-1-yl]-3-methylbutan-1-one
1-[4-(7-benzoyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)piperidin-1-yl]-3-methylbutan-1-one
Compound characteristics
| Compound ID: | S903-1418 |
| Compound Name: | 1-[4-(7-benzoyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl)piperidin-1-yl]-3-methylbutan-1-one |
| Molecular Weight: | 395.5 |
| Molecular Formula: | C22 H29 N5 O2 |
| Smiles: | CC(C)CC(N1CCC(CC1)c1nnc2CN(CCn12)C(c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5553 |
| logD: | 1.5553 |
| logSw: | -1.9247 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 57.714 |
| InChI Key: | BHXFIKZRQJKUPD-UHFFFAOYSA-N |