N-[(furan-2-yl)methyl]-N~3~-[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-beta-alaninamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-N~3~-[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-beta-alaninamide
N-[(furan-2-yl)methyl]-N~3~-[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-beta-alaninamide
Compound characteristics
| Compound ID: | D494-0625 |
| Compound Name: | N-[(furan-2-yl)methyl]-N~3~-[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-beta-alaninamide |
| Molecular Weight: | 377.4 |
| Molecular Formula: | C19 H19 N7 O2 |
| Smiles: | Cc1cc(NCCC(NCc2ccco2)=O)n2c(n1)nc(c1cccnc1)n2 |
| Stereo: | ACHIRAL |
| logP: | 1.3254 |
| logD: | 1.1718 |
| logSw: | -1.3188 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.742 |
| InChI Key: | YPKQZMHTKHCMEC-UHFFFAOYSA-N |