N-(2-methoxyphenyl)-2-{[(2-methylphenyl)methyl]sulfanyl}-5-[(4-methylphenyl)sulfanyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-(2-methoxyphenyl)-2-{[(2-methylphenyl)methyl]sulfanyl}-5-[(4-methylphenyl)sulfanyl]pyrimidine-4-carboxamide
N-(2-methoxyphenyl)-2-{[(2-methylphenyl)methyl]sulfanyl}-5-[(4-methylphenyl)sulfanyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D506-0148 |
| Compound Name: | N-(2-methoxyphenyl)-2-{[(2-methylphenyl)methyl]sulfanyl}-5-[(4-methylphenyl)sulfanyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 487.64 |
| Molecular Formula: | C27 H25 N3 O2 S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccccc1C)Sc1ccc(C)cc1)=O)c1ccccc1OC |
| Stereo: | ACHIRAL |
| logP: | 7.5037 |
| logD: | 7.503 |
| logSw: | -5.5527 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.305 |
| InChI Key: | OHTRMYQYSIXCNQ-UHFFFAOYSA-N |