N-(4-chlorophenyl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
N-(4-chlorophenyl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0363 |
| Compound Name: | N-(4-chlorophenyl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide |
| Molecular Weight: | 355.84 |
| Molecular Formula: | C18 H14 Cl N3 O S |
| Smiles: | CSc1ncc(C(Nc2ccc(cc2)[Cl])=O)c(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.4933 |
| logD: | 4.4918 |
| logSw: | -4.8323 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.643 |
| InChI Key: | BYMQDHXJIBTWTK-UHFFFAOYSA-N |