N-(3-chloro-4-methoxyphenyl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-methoxyphenyl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
N-(3-chloro-4-methoxyphenyl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | E727-0464 |
| Compound Name: | N-(3-chloro-4-methoxyphenyl)-2-(methylsulfanyl)-4-phenylpyrimidine-5-carboxamide |
| Molecular Weight: | 385.87 |
| Molecular Formula: | C19 H16 Cl N3 O2 S |
| Smiles: | COc1ccc(cc1[Cl])NC(c1cnc(nc1c1ccccc1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4092 |
| logD: | 4.4054 |
| logSw: | -4.6713 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.274 |
| InChI Key: | OQXRGQKNHATDFQ-UHFFFAOYSA-N |