7-(2,3-dimethoxyphenyl)-N-(4-methoxyphenyl)-5-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Chemical Structure Depiction of
7-(2,3-dimethoxyphenyl)-N-(4-methoxyphenyl)-5-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
7-(2,3-dimethoxyphenyl)-N-(4-methoxyphenyl)-5-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | C202-2234 |
| Compound Name: | 7-(2,3-dimethoxyphenyl)-N-(4-methoxyphenyl)-5-methyl-2-{[(2-methylphenyl)methyl]sulfanyl}-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide |
| Molecular Weight: | 557.67 |
| Molecular Formula: | C30 H31 N5 O4 S |
| Smiles: | CC1=C(C(c2cccc(c2OC)OC)n2c(N1)nc(n2)SCc1ccccc1C)C(Nc1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2135 |
| logD: | 6.213 |
| logSw: | -5.5779 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.482 |
| InChI Key: | RTJCRTZKWQZZNS-SANMLTNESA-N |