4-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl 3-fluorobenzoate
Chemical Structure Depiction of
4-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl 3-fluorobenzoate
4-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl 3-fluorobenzoate
Compound characteristics
| Compound ID: | D494-0753 |
| Compound Name: | 4-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}phenyl 3-fluorobenzoate |
| Molecular Weight: | 440.44 |
| Molecular Formula: | C24 H17 F N6 O2 |
| Smiles: | Cc1cc(Nc2ccc(cc2)OC(c2cccc(c2)F)=O)n2c(n1)nc(c1cccnc1)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.7569 |
| logD: | 3.6142 |
| logSw: | -3.8236 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.736 |
| InChI Key: | VLVOSTLLKIUWQV-UHFFFAOYSA-N |