2-(benzylsulfanyl)-5-[(4-chlorophenyl)sulfanyl]-N-(pyridin-3-yl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
2-(benzylsulfanyl)-5-[(4-chlorophenyl)sulfanyl]-N-(pyridin-3-yl)pyrimidine-4-carboxamide
2-(benzylsulfanyl)-5-[(4-chlorophenyl)sulfanyl]-N-(pyridin-3-yl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D390-0632 |
| Compound Name: | 2-(benzylsulfanyl)-5-[(4-chlorophenyl)sulfanyl]-N-(pyridin-3-yl)pyrimidine-4-carboxamide |
| Molecular Weight: | 464.99 |
| Molecular Formula: | C23 H17 Cl N4 O S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCc1ccccc1)Sc1ccc(cc1)[Cl])=O)c1cccnc1 |
| Stereo: | ACHIRAL |
| logP: | 5.5695 |
| logD: | 5.569 |
| logSw: | -5.9772 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.89 |
| InChI Key: | ZOBBLVLCOSZKHP-UHFFFAOYSA-N |