ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-5-{[2-(ethoxycarbonyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-5-{[2-(ethoxycarbonyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate
ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-5-{[2-(ethoxycarbonyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | K813-0007 |
| Compound Name: | ethyl 2-[4-(2,4-dichlorophenoxy)butanamido]-5-{[2-(ethoxycarbonyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate |
| Molecular Weight: | 607.51 |
| Molecular Formula: | C28 H28 Cl2 N2 O7 S |
| Smiles: | CCOC(c1ccccc1NC(c1c(C)c(C(=O)OCC)c(NC(CCCOc2ccc(cc2[Cl])[Cl])=O)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9041 |
| logD: | 2.8158 |
| logSw: | -5.9722 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.316 |
| InChI Key: | YICRRLYYNCVRNR-UHFFFAOYSA-N |