4-{[2-(methoxycarbonyl)thiophen-3-yl]amino}-4-oxobut-2-enoic acid
Chemical Structure Depiction of
4-{[2-(methoxycarbonyl)thiophen-3-yl]amino}-4-oxobut-2-enoic acid
4-{[2-(methoxycarbonyl)thiophen-3-yl]amino}-4-oxobut-2-enoic acid
Compound characteristics
| Compound ID: | 3365-1359 |
| Compound Name: | 4-{[2-(methoxycarbonyl)thiophen-3-yl]amino}-4-oxobut-2-enoic acid |
| Molecular Weight: | 255.25 |
| Molecular Formula: | C10 H9 N O5 S |
| Smiles: | COC(c1c(ccs1)NC(/C=C/C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.251 |
| logD: | -3.2074 |
| logSw: | -1.9536 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.266 |
| InChI Key: | ZHBJFZVUANLMAR-UHFFFAOYSA-N |