3-[2-(cyclohexylamino)pyrimidin-5-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
Chemical Structure Depiction of
3-[2-(cyclohexylamino)pyrimidin-5-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
3-[2-(cyclohexylamino)pyrimidin-5-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | L368-0528 |
| Compound Name: | 3-[2-(cyclohexylamino)pyrimidin-5-yl]-N-{[4-(methylsulfanyl)phenyl]methyl}benzamide |
| Molecular Weight: | 432.59 |
| Molecular Formula: | C25 H28 N4 O S |
| Smiles: | CSc1ccc(CNC(c2cccc(c2)c2cnc(NC3CCCCC3)nc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.2379 |
| logD: | 5.2378 |
| logSw: | -4.8722 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.089 |
| InChI Key: | LHUDTYLJJWXIIU-UHFFFAOYSA-N |