3-{[5-(4-methylphenyl)pyrimidin-2-yl]amino}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
Chemical Structure Depiction of
3-{[5-(4-methylphenyl)pyrimidin-2-yl]amino}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
3-{[5-(4-methylphenyl)pyrimidin-2-yl]amino}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
Compound characteristics
Compound ID: | L369-0379 |
Compound Name: | 3-{[5-(4-methylphenyl)pyrimidin-2-yl]amino}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide |
Molecular Weight: | 440.57 |
Molecular Formula: | C26 H24 N4 O S |
Smiles: | Cc1ccc(cc1)c1cnc(Nc2cccc(c2)C(NCc2ccc(cc2)SC)=O)nc1 |
Stereo: | ACHIRAL |
logP: | 5.8515 |
logD: | 5.8515 |
logSw: | -5.4012 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 54.041 |
InChI Key: | QDGGNGXULJUENV-UHFFFAOYSA-N |