7-(4-chlorophenyl)-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-N-(2-methoxyphenyl)-5-methyl-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}-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
7-(4-chlorophenyl)-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G922-0862 |
| Compound Name: | 7-(4-chlorophenyl)-2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-N-(2-methoxyphenyl)-5-methyl-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 546.09 |
| Molecular Formula: | C29 H28 Cl N5 O2 S |
| Smiles: | CC1=C(C(c2ccc(cc2)[Cl])n2c(N1)nc(n2)SCc1cc(C)ccc1C)C(Nc1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.338 |
| logD: | 7.3374 |
| logSw: | -6.4347 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.523 |
| InChI Key: | RKRAEKSCPKCUHZ-SANMLTNESA-N |