methyl 2-(2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamido)benzoate
Chemical Structure Depiction of
methyl 2-(2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamido)benzoate
methyl 2-(2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamido)benzoate
Compound characteristics
| Compound ID: | 6466-0953 |
| Compound Name: | methyl 2-(2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamido)benzoate |
| Molecular Weight: | 437.4 |
| Molecular Formula: | C19 H14 F3 N3 O4 S |
| Smiles: | COC(c1ccccc1NC(CSc1nc(cc(C(F)(F)F)n1)c1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.94 |
| logD: | 3.927 |
| logSw: | -4.0367 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.192 |
| InChI Key: | ZICLXDJSKYCLOL-UHFFFAOYSA-N |