methyl 4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]benzoate
methyl 4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]benzoate
Compound characteristics
| Compound ID: | C301-9098 |
| Compound Name: | methyl 4-[(5,6-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)amino]benzoate |
| Molecular Weight: | 297.31 |
| Molecular Formula: | C15 H15 N5 O2 |
| Smiles: | Cc1c(C)nc2ncnn2c1Nc1ccc(cc1)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.4934 |
| logD: | 2.4909 |
| logSw: | -2.9407 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.075 |
| InChI Key: | MVHDVAVYOFDLHZ-UHFFFAOYSA-N |