7-(4-chlorophenyl)-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
7-(4-chlorophenyl)-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
7-(4-chlorophenyl)-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G922-0834 |
| Compound Name: | 7-(4-chlorophenyl)-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-5-methyl-N-phenyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 516.06 |
| Molecular Formula: | C28 H26 Cl N5 O S |
| Smiles: | CC1=C(C(c2ccc(cc2)[Cl])n2c(N1)nc(n2)SCc1cc(C)ccc1C)C(Nc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.1949 |
| logD: | 7.1944 |
| logSw: | -6.4045 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.591 |
| InChI Key: | JIIJVWFSEVUVGT-VWLOTQADSA-N |