N-(3-{[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propyl)-3-phenylpropanamide
Chemical Structure Depiction of
N-(3-{[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propyl)-3-phenylpropanamide
N-(3-{[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propyl)-3-phenylpropanamide
Compound characteristics
| Compound ID: | 6466-0487 |
| Compound Name: | N-(3-{[4-tert-butyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propyl)-3-phenylpropanamide |
| Molecular Weight: | 425.52 |
| Molecular Formula: | C21 H26 F3 N3 O S |
| Smiles: | CC(C)(C)c1cc(C(F)(F)F)nc(n1)SCCCNC(CCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0216 |
| logD: | 5.0216 |
| logSw: | -4.7028 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.573 |
| InChI Key: | BEDQTJAAVIUUMU-UHFFFAOYSA-N |