2-(benzylsulfanyl)-5-[(4-methylphenyl)sulfanyl]-N-(1,3-thiazol-2-yl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
2-(benzylsulfanyl)-5-[(4-methylphenyl)sulfanyl]-N-(1,3-thiazol-2-yl)pyrimidine-4-carboxamide
2-(benzylsulfanyl)-5-[(4-methylphenyl)sulfanyl]-N-(1,3-thiazol-2-yl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D390-0607 |
| Compound Name: | 2-(benzylsulfanyl)-5-[(4-methylphenyl)sulfanyl]-N-(1,3-thiazol-2-yl)pyrimidine-4-carboxamide |
| Molecular Weight: | 450.6 |
| Molecular Formula: | C22 H18 N4 O S3 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccccc1)Sc1ccc(C)cc1)=O)c1nccs1 |
| Stereo: | ACHIRAL |
| logP: | 5.7402 |
| logD: | 5.7333 |
| logSw: | -5.2759 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.85 |
| InChI Key: | LKODFCLGDQGPIZ-UHFFFAOYSA-N |