4-{[6-(3-fluorophenyl)pyrimidin-4-yl]amino}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
Chemical Structure Depiction of
4-{[6-(3-fluorophenyl)pyrimidin-4-yl]amino}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
4-{[6-(3-fluorophenyl)pyrimidin-4-yl]amino}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | F733-1006 |
| Compound Name: | 4-{[6-(3-fluorophenyl)pyrimidin-4-yl]amino}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide |
| Molecular Weight: | 444.53 |
| Molecular Formula: | C25 H21 F N4 O S |
| Smiles: | CSc1ccc(CNC(c2ccc(cc2)Nc2cc(c3cccc(c3)F)ncn2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.65 |
| logD: | 5.5839 |
| logSw: | -5.5647 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.67 |
| InChI Key: | LGTZODMPXNCNGF-UHFFFAOYSA-N |