2-{[(4-methylphenyl)methyl]sulfanyl}-5-[(4-methylphenyl)sulfanyl]-N-(pyridin-4-yl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
2-{[(4-methylphenyl)methyl]sulfanyl}-5-[(4-methylphenyl)sulfanyl]-N-(pyridin-4-yl)pyrimidine-4-carboxamide
2-{[(4-methylphenyl)methyl]sulfanyl}-5-[(4-methylphenyl)sulfanyl]-N-(pyridin-4-yl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D390-0708 |
| Compound Name: | 2-{[(4-methylphenyl)methyl]sulfanyl}-5-[(4-methylphenyl)sulfanyl]-N-(pyridin-4-yl)pyrimidine-4-carboxamide |
| Molecular Weight: | 458.6 |
| Molecular Formula: | C25 H22 N4 O S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccc(C)cc1)Sc1ccc(C)cc1)=O)c1ccncc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7189 |
| logD: | 5.7174 |
| logSw: | -5.0719 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.8 |
| InChI Key: | ZTYLYPMWNSCCSC-UHFFFAOYSA-N |