ethyl 7-(3-bromo-4-fluorophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 7-(3-bromo-4-fluorophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
ethyl 7-(3-bromo-4-fluorophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K832-3196 |
| Compound Name: | ethyl 7-(3-bromo-4-fluorophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 381.2 |
| Molecular Formula: | C15 H14 Br F N4 O2 |
| Smiles: | CCOC(C1C(c2ccc(c(c2)[Br])F)n2c(NC=1C)ncn2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0703 |
| logD: | 2.782 |
| logSw: | -3.1627 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.743 |
| InChI Key: | CAKFLBUJMMHGIO-ZDUSSCGKSA-N |