N-butyl-3-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzamide
Chemical Structure Depiction of
N-butyl-3-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzamide
N-butyl-3-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzamide
Compound characteristics
| Compound ID: | D515-0691 |
| Compound Name: | N-butyl-3-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzamide |
| Molecular Weight: | 401.47 |
| Molecular Formula: | C22 H23 N7 O |
| Smiles: | CCCCNC(c1cccc(c1)Nc1cc(C)nc2nc(c3cccnc3)nn12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2653 |
| logD: | 3.1225 |
| logSw: | -3.1137 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.884 |
| InChI Key: | PNRKNNXSKBCEAD-UHFFFAOYSA-N |