N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzenesulfonamide--hydrogen chloride (1/1)
Chemical Structure Depiction of
N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzenesulfonamide--hydrogen chloride (1/1)
N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzenesulfonamide--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D413-0011 |
| Compound Name: | N-[7-(4-chlorophenyl)-5-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]benzenesulfonamide--hydrogen chloride (1/1) |
| Molecular Weight: | 500.41 |
| Molecular Formula: | C23 H18 Cl N5 O2 S |
| Salt: | HCl |
| Smiles: | C1C(c2ccc(cc2)[Cl])n2c(NC=1c1ccccc1)nc(NS(c1ccccc1)(=O)=O)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1392 |
| logD: | 3.8969 |
| logSw: | -6.042 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.443 |
| InChI Key: | NIOCZZPEPMNWSU-NRFANRHFSA-N |