1-[7-(4-bromophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethan-1-one
Chemical Structure Depiction of
1-[7-(4-bromophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethan-1-one
1-[7-(4-bromophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethan-1-one
Compound characteristics
| Compound ID: | C202-1380 |
| Compound Name: | 1-[7-(4-bromophenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethan-1-one |
| Molecular Weight: | 333.18 |
| Molecular Formula: | C14 H13 Br N4 O |
| Smiles: | CC1=C(C(c2ccc(cc2)[Br])n2c(N1)ncn2)C(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6525 |
| logD: | 2.5844 |
| logSw: | -3.0187 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.817 |
| InChI Key: | KXEGXFPJYMLUGL-ZDUSSCGKSA-N |