ethyl 7-(4-bromophenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 7-(4-bromophenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
ethyl 7-(4-bromophenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K832-3583 |
| Compound Name: | ethyl 7-(4-bromophenyl)-5-(trifluoromethyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 417.18 |
| Molecular Formula: | C15 H12 Br F3 N4 O2 |
| Smiles: | CCOC(C1C(c2ccc(cc2)[Br])n2c(NC=1C(F)(F)F)ncn2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.843 |
| logD: | -0.3498 |
| logSw: | -3.9089 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.245 |
| InChI Key: | UERXRYCNVYTGBN-NSHDSACASA-N |