ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-5-[(2-fluorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-5-[(2-fluorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate
ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-5-[(2-fluorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | K813-0004 |
| Compound Name: | ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-5-[(2-fluorophenyl)carbamoyl]-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 553.44 |
| Molecular Formula: | C25 H23 Cl2 F N2 O5 S |
| Smiles: | CCOC(c1c(C)c(C(Nc2ccccc2F)=O)sc1NC(CCCOc1ccc(cc1[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.416 |
| logD: | 2.3277 |
| logSw: | -5.9899 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.562 |
| InChI Key: | VRADUIKEIQHOPU-UHFFFAOYSA-N |