2-{[(2-methylphenyl)methyl]sulfanyl}-N-(5-methyl-1,3-thiazol-2-yl)-5-(phenylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
2-{[(2-methylphenyl)methyl]sulfanyl}-N-(5-methyl-1,3-thiazol-2-yl)-5-(phenylsulfanyl)pyrimidine-4-carboxamide
2-{[(2-methylphenyl)methyl]sulfanyl}-N-(5-methyl-1,3-thiazol-2-yl)-5-(phenylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D506-0118 |
| Compound Name: | 2-{[(2-methylphenyl)methyl]sulfanyl}-N-(5-methyl-1,3-thiazol-2-yl)-5-(phenylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 464.63 |
| Molecular Formula: | C23 H20 N4 O S3 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccccc1C)Sc1ccccc1)=O)c1ncc(C)s1 |
| Stereo: | ACHIRAL |
| logP: | 7.1333 |
| logD: | 7.0571 |
| logSw: | -5.5736 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.94 |
| InChI Key: | RPNAXZKACRTGJV-UHFFFAOYSA-N |