N-(butan-2-yl)-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-(butan-2-yl)-N~3~-[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-beta-alaninamide
N-(butan-2-yl)-N~3~-[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-beta-alaninamide
Compound characteristics
| Compound ID: | D494-0624 |
| Compound Name: | N-(butan-2-yl)-N~3~-[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]-beta-alaninamide |
| Molecular Weight: | 353.43 |
| Molecular Formula: | C18 H23 N7 O |
| Smiles: | CCC(C)NC(CCNc1cc(C)nc2nc(c3cccnc3)nn12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.1703 |
| logD: | 1.0168 |
| logSw: | -1.3136 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.706 |
| InChI Key: | VTBRMRKADOVURH-LBPRGKRZSA-N |