7-(5-bromo-2-fluorophenyl)-5-(3-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Chemical Structure Depiction of
7-(5-bromo-2-fluorophenyl)-5-(3-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
7-(5-bromo-2-fluorophenyl)-5-(3-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Compound characteristics
| Compound ID: | K832-2035 |
| Compound Name: | 7-(5-bromo-2-fluorophenyl)-5-(3-nitrophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine |
| Molecular Weight: | 416.21 |
| Molecular Formula: | C17 H11 Br F N5 O2 |
| Smiles: | C1C(c2cc(ccc2F)[Br])n2c(NC=1c1cccc(c1)[N+]([O-])=O)ncn2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6035 |
| logD: | 4.5936 |
| logSw: | -4.5881 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.981 |
| InChI Key: | SHRIHTZTXSJPFE-INIZCTEOSA-N |