4-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl 3-phenylpropanoate
Chemical Structure Depiction of
4-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl 3-phenylpropanoate
4-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl 3-phenylpropanoate
Compound characteristics
| Compound ID: | D494-0729 |
| Compound Name: | 4-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl 3-phenylpropanoate |
| Molecular Weight: | 450.5 |
| Molecular Formula: | C26 H22 N6 O2 |
| Smiles: | Cc1cc(Nc2ccc(cc2)OC(CCc2ccccc2)=O)n2c(n1)nc(c1cccnc1)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.3812 |
| logD: | 4.2384 |
| logSw: | -4.2521 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.141 |
| InChI Key: | RYJTUAGYFMKPOG-UHFFFAOYSA-N |