ethyl 7-(5-bromo-2-methoxyphenyl)-5-propyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 7-(5-bromo-2-methoxyphenyl)-5-propyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
ethyl 7-(5-bromo-2-methoxyphenyl)-5-propyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | K832-3879 |
| Compound Name: | ethyl 7-(5-bromo-2-methoxyphenyl)-5-propyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 421.29 |
| Molecular Formula: | C18 H21 Br N4 O3 |
| Smiles: | CCCC1=C(C(c2cc(ccc2OC)[Br])n2c(N1)ncn2)C(=O)OCC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4466 |
| logD: | 3.8851 |
| logSw: | -4.3209 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.981 |
| InChI Key: | ZGSZOCMKFHLQLR-INIZCTEOSA-N |