2-{[(4-methylphenyl)methyl]sulfanyl}-5-[(4-methylphenyl)sulfanyl]-N-(3-methylpyridin-2-yl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
2-{[(4-methylphenyl)methyl]sulfanyl}-5-[(4-methylphenyl)sulfanyl]-N-(3-methylpyridin-2-yl)pyrimidine-4-carboxamide
2-{[(4-methylphenyl)methyl]sulfanyl}-5-[(4-methylphenyl)sulfanyl]-N-(3-methylpyridin-2-yl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D390-0711 |
| Compound Name: | 2-{[(4-methylphenyl)methyl]sulfanyl}-5-[(4-methylphenyl)sulfanyl]-N-(3-methylpyridin-2-yl)pyrimidine-4-carboxamide |
| Molecular Weight: | 472.63 |
| Molecular Formula: | C26 H24 N4 O S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccc(C)cc1)Sc1ccc(C)cc1)=O)c1c(C)cccn1 |
| Stereo: | ACHIRAL |
| logP: | 6.4961 |
| logD: | 6.4928 |
| logSw: | -5.4032 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.06 |
| InChI Key: | LILOHUZUCFHIOD-UHFFFAOYSA-N |