N~3~-[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-N-[(pyridin-3-yl)methyl]-beta-alaninamide
Chemical Structure Depiction of
N~3~-[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-N-[(pyridin-3-yl)methyl]-beta-alaninamide
N~3~-[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-N-[(pyridin-3-yl)methyl]-beta-alaninamide
Compound characteristics
| Compound ID: | D494-0603 |
| Compound Name: | N~3~-[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-N-[(pyridin-3-yl)methyl]-beta-alaninamide |
| Molecular Weight: | 388.43 |
| Molecular Formula: | C20 H20 N8 O |
| Smiles: | Cc1cc(NCCC(NCc2cccnc2)=O)n2c(n1)nc(c1cccnc1)n2 |
| Stereo: | ACHIRAL |
| logP: | 0.347 |
| logD: | 0.1934 |
| logSw: | -1.0368 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.511 |
| InChI Key: | UXZYOCJEMZPMDT-UHFFFAOYSA-N |