4-chloro-N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzene-1-sulfonamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-chloro-N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzene-1-sulfonamide--hydrogen chloride (1/1)
4-chloro-N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzene-1-sulfonamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D413-0013 |
| Compound Name: | 4-chloro-N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzene-1-sulfonamide--hydrogen chloride (1/1) |
| Molecular Weight: | 534.85 |
| Molecular Formula: | C23 H17 Cl2 N5 O2 S |
| Salt: | HCl |
| Smiles: | C1C(c2ccc(cc2)[Cl])n2c(NC=1c1ccccc1)nc(NS(c1ccc(cc1)[Cl])(=O)=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9189 |
| logD: | 4.2723 |
| logSw: | -6.527 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.443 |
| InChI Key: | AFANQDNNMAJAOD-NRFANRHFSA-N |