ethyl 2-(2-cyano-3-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}prop-2-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-cyano-3-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}prop-2-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-(2-cyano-3-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}prop-2-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3448-3370 |
| Compound Name: | ethyl 2-(2-cyano-3-{5-[3-(trifluoromethyl)phenyl]furan-2-yl}prop-2-enamido)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 514.52 |
| Molecular Formula: | C26 H21 F3 N2 O4 S |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(C(=C/c1ccc(c2cccc(c2)C(F)(F)F)o1)\C#N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5642 |
| logD: | 1.6368 |
| logSw: | -5.8121 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.424 |
| InChI Key: | APCFYQLDRNFPGK-UHFFFAOYSA-N |