1-[4-(5-methylthiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]azepane
Chemical Structure Depiction of
1-[4-(5-methylthiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]azepane
1-[4-(5-methylthiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]azepane
Compound characteristics
| Compound ID: | Y505-0519 |
| Compound Name: | 1-[4-(5-methylthiophen-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]azepane |
| Molecular Weight: | 341.4 |
| Molecular Formula: | C16 H18 F3 N3 S |
| Smiles: | Cc1ccc(c2cc(C(F)(F)F)nc(n2)N2CCCCCC2)s1 |
| Stereo: | ACHIRAL |
| logP: | 6.0455 |
| logD: | 6.0455 |
| logSw: | -5.6139 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 22.2669 |
| InChI Key: | XUHAHKFSIZZRJC-UHFFFAOYSA-N |