7-(4-ethoxyphenyl)-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-(4-ethoxyphenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-5-methyl-N-(2-methylphenyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
7-(4-ethoxyphenyl)-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: | G922-0224 |
| Compound Name: | 7-(4-ethoxyphenyl)-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: | 541.67 |
| Molecular Formula: | C30 H31 N5 O3 S |
| Smiles: | CCOc1ccc(cc1)C1C(=C(C)Nc2nc(nn12)SCc1cccc(c1)OC)C(Nc1ccccc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9818 |
| logD: | 5.9813 |
| logSw: | -5.4717 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.56 |
| InChI Key: | HTXCNQTVENXFBQ-MHZLTWQESA-N |