methyl 3-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzoate
Chemical Structure Depiction of
methyl 3-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzoate
methyl 3-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzoate
Compound characteristics
| Compound ID: | D515-0781 |
| Compound Name: | methyl 3-{[5-methyl-2-(pyridin-3-yl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}benzoate |
| Molecular Weight: | 360.37 |
| Molecular Formula: | C19 H16 N6 O2 |
| Smiles: | Cc1cc(Nc2cccc(c2)C(=O)OC)n2c(n1)nc(c1cccnc1)n2 |
| Stereo: | ACHIRAL |
| logP: | 2.9263 |
| logD: | 2.7836 |
| logSw: | -3.1005 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.532 |
| InChI Key: | CTQPLFBMKMPKDO-UHFFFAOYSA-N |