N-tert-butyl-3-{1-[(pyridin-4-yl)methyl]piperidin-3-yl}-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide
Chemical Structure Depiction of
N-tert-butyl-3-{1-[(pyridin-4-yl)methyl]piperidin-3-yl}-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide
N-tert-butyl-3-{1-[(pyridin-4-yl)methyl]piperidin-3-yl}-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide
Compound characteristics
| Compound ID: | S585-1318 |
| Compound Name: | N-tert-butyl-3-{1-[(pyridin-4-yl)methyl]piperidin-3-yl}-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxamide |
| Molecular Weight: | 397.52 |
| Molecular Formula: | C21 H31 N7 O |
| Smiles: | CC(C)(C)NC(N1CCn2c(C1)nnc2C1CCCN(C1)Cc1ccncc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9139 |
| logD: | 0.524 |
| logSw: | -1.48 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.654 |
| InChI Key: | APOWFZXYGUMPGS-KRWDZBQOSA-N |