methyl 5-methyl-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-methyl-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
methyl 5-methyl-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | Y021-2636 |
| Compound Name: | methyl 5-methyl-2-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 270.29 |
| Molecular Formula: | C14 H14 N4 O2 |
| Smiles: | CC1=C(Cn2c(N1)nc(c1ccccc1)n2)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.2773 |
| logD: | 2.2195 |
| logSw: | -2.8331 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.405 |
| InChI Key: | AXBSZJLMVUEQJX-UHFFFAOYSA-N |