4-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
Chemical Structure Depiction of
4-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
4-{[5-(3-fluorophenyl)pyrimidin-2-yl]amino}-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | L370-0529 |
| Compound Name: | 4-{[5-(3-fluorophenyl)pyrimidin-2-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)Nc2ncc(cn2)c2cccc(c2)F)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1929 |
| logD: | 5.1929 |
| logSw: | -4.9647 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.041 |
| InChI Key: | QWTAVSHDPKFNOK-UHFFFAOYSA-N |