7-(3-chlorophenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(2-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
7-(3-chlorophenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(2-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
7-(3-chlorophenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(2-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | G922-0219 |
| Compound Name: | 7-(3-chlorophenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(2-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 532.06 |
| Molecular Formula: | C28 H26 Cl N5 O2 S |
| Smiles: | CC1=C(C(c2cccc(c2)[Cl])n2c(N1)nc(n2)SCc1cccc(c1)OC)C(Nc1ccccc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2158 |
| logD: | 6.2153 |
| logSw: | -6.1154 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.437 |
| InChI Key: | ZLWQRJRMDDURGE-VWLOTQADSA-N |