ethyl 4-fluoro-3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
ethyl 4-fluoro-3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)-1-benzothiophene-2-carboxylate
ethyl 4-fluoro-3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | G226-0308 |
| Compound Name: | ethyl 4-fluoro-3-(4-phenyl-3,6-dihydropyridine-1(2H)-sulfonyl)-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 445.53 |
| Molecular Formula: | C22 H20 F N O4 S2 |
| Smiles: | CCOC(c1c(c2c(cccc2s1)F)S(N1CCC(=CC1)c1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1978 |
| logD: | 5.1978 |
| logSw: | -5.2767 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.178 |
| InChI Key: | MUPJMSAGQFPPGD-UHFFFAOYSA-N |