4-(5-chloro-2-methoxyanilino)-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
Chemical Structure Depiction of
4-(5-chloro-2-methoxyanilino)-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
4-(5-chloro-2-methoxyanilino)-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | D490-0479 |
| Compound Name: | 4-(5-chloro-2-methoxyanilino)-2-(methylsulfanyl)-6-phenylpyrimidine-5-carbonitrile |
| Molecular Weight: | 382.87 |
| Molecular Formula: | C19 H15 Cl N4 O S |
| Smiles: | COc1ccc(cc1Nc1c(C#N)c(c2ccccc2)nc(n1)SC)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.1976 |
| logD: | 5.1976 |
| logSw: | -5.8778 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.572 |
| InChI Key: | CLMDLNDXRNBDPD-UHFFFAOYSA-N |