4-{[3-(ethoxycarbonyl)-4,5-dimethylthiophen-2-yl]amino}-4-oxobutanoic acid
Chemical Structure Depiction of
4-{[3-(ethoxycarbonyl)-4,5-dimethylthiophen-2-yl]amino}-4-oxobutanoic acid
4-{[3-(ethoxycarbonyl)-4,5-dimethylthiophen-2-yl]amino}-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 0536-0938 |
| Compound Name: | 4-{[3-(ethoxycarbonyl)-4,5-dimethylthiophen-2-yl]amino}-4-oxobutanoic acid |
| Molecular Weight: | 299.34 |
| Molecular Formula: | C13 H17 N O5 S |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(CCC(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.424 |
| logD: | -1.526 |
| logSw: | -1.792 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.32 |
| InChI Key: | CEUBXXKPXQZBDU-UHFFFAOYSA-N |