methyl {[5-methyl-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}(phenyl)acetate
Chemical Structure Depiction of
methyl {[5-methyl-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}(phenyl)acetate
methyl {[5-methyl-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}(phenyl)acetate
Compound characteristics
| Compound ID: | D245-0379 |
| Compound Name: | methyl {[5-methyl-2-(2-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]amino}(phenyl)acetate |
| Molecular Weight: | 387.44 |
| Molecular Formula: | C22 H21 N5 O2 |
| Smiles: | Cc1ccccc1c1nc2nc(C)cc(NC(C(=O)OC)c3ccccc3)n2n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5854 |
| logD: | 3.5236 |
| logSw: | -3.6962 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.688 |
| InChI Key: | XKMAYYVIVYLCLU-LJQANCHMSA-N |