N-[5-(4-chlorophenyl)-7-(4-fluorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzenesulfonamide
Chemical Structure Depiction of
N-[5-(4-chlorophenyl)-7-(4-fluorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzenesulfonamide
N-[5-(4-chlorophenyl)-7-(4-fluorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzenesulfonamide
Compound characteristics
| Compound ID: | D413-0253 |
| Compound Name: | N-[5-(4-chlorophenyl)-7-(4-fluorophenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzenesulfonamide |
| Molecular Weight: | 481.93 |
| Molecular Formula: | C23 H17 Cl F N5 O2 S |
| Smiles: | C1C(c2ccc(cc2)F)n2c(NC=1c1ccc(cc1)[Cl])nc(NS(c1ccccc1)(=O)=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2733 |
| logD: | 4.0311 |
| logSw: | -6.2619 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.443 |
| InChI Key: | KMBVVBWICBOMHY-OAQYLSRUSA-N |