N-(3,4-dimethoxyphenyl)-4-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}butanamide
Chemical Structure Depiction of
N-(3,4-dimethoxyphenyl)-4-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}butanamide
N-(3,4-dimethoxyphenyl)-4-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}butanamide
Compound characteristics
| Compound ID: | 7213-0333 |
| Compound Name: | N-(3,4-dimethoxyphenyl)-4-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}butanamide |
| Molecular Weight: | 467.47 |
| Molecular Formula: | C21 H20 F3 N3 O4 S |
| Smiles: | COc1ccc(cc1OC)NC(CCCSc1nc(cc(C(F)(F)F)n1)c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8894 |
| logD: | 3.8893 |
| logSw: | -4.0025 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.977 |
| InChI Key: | BVAIVGXZBLKFNF-UHFFFAOYSA-N |