2-(benzylsulfanyl)-5-chloro-N-(4-chlorophenyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
2-(benzylsulfanyl)-5-chloro-N-(4-chlorophenyl)pyrimidine-4-carboxamide
2-(benzylsulfanyl)-5-chloro-N-(4-chlorophenyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | IB07-2783 |
| Compound Name: | 2-(benzylsulfanyl)-5-chloro-N-(4-chlorophenyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 390.29 |
| Molecular Formula: | C18 H13 Cl2 N3 O S |
| Smiles: | C(c1ccccc1)Sc1ncc(c(C(Nc2ccc(cc2)[Cl])=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.14 |
| logD: | 5.08 |
| logSw: | -6.2 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.75 |
| InChI Key: | VPPBFVUIUKDZAR-UHFFFAOYSA-N |