4-{[4-(3-chlorophenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]amino}-4-oxobutanoic acid
Chemical Structure Depiction of
4-{[4-(3-chlorophenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]amino}-4-oxobutanoic acid
4-{[4-(3-chlorophenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]amino}-4-oxobutanoic acid
Compound characteristics
| Compound ID: | Y200-4022 |
| Compound Name: | 4-{[4-(3-chlorophenyl)-3-(ethoxycarbonyl)-5-methylthiophen-2-yl]amino}-4-oxobutanoic acid |
| Molecular Weight: | 395.86 |
| Molecular Formula: | C18 H18 Cl N O5 S |
| Smiles: | CCOC(c1c(c2cccc(c2)[Cl])c(C)sc1NC(CCC(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2345 |
| logD: | 0.2851 |
| logSw: | -3.622 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.048 |
| InChI Key: | JNHPGCHCTMWUJS-UHFFFAOYSA-N |