N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanamide
Compound characteristics
| Compound ID: | 7213-0243 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-3-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}propanamide |
| Molecular Weight: | 481.49 |
| Molecular Formula: | C22 H22 F3 N3 O4 S |
| Smiles: | COc1ccc(CCNC(CCSc2nc(cc(C(F)(F)F)n2)c2ccco2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.3071 |
| logD: | 3.3071 |
| logSw: | -3.685 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.141 |
| InChI Key: | RWBYTKUBPQLZDW-UHFFFAOYSA-N |