ethyl 5-(4,4-dimethylpentan-2-yl)-2-(3-fluorobenzamido)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(4,4-dimethylpentan-2-yl)-2-(3-fluorobenzamido)thiophene-3-carboxylate
ethyl 5-(4,4-dimethylpentan-2-yl)-2-(3-fluorobenzamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | V012-4310 |
| Compound Name: | ethyl 5-(4,4-dimethylpentan-2-yl)-2-(3-fluorobenzamido)thiophene-3-carboxylate |
| Molecular Weight: | 391.5 |
| Molecular Formula: | C21 H26 F N O3 S |
| Smiles: | CCOC(c1cc(C(C)CC(C)(C)C)sc1NC(c1cccc(c1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8332 |
| logD: | 2.3761 |
| logSw: | -5.5173 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.878 |
| InChI Key: | MEIQKNCXFNFPIG-ZDUSSCGKSA-N |