6-{[3-(ethoxycarbonyl)-4-(4-ethoxyphenyl)thiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Chemical Structure Depiction of
6-{[3-(ethoxycarbonyl)-4-(4-ethoxyphenyl)thiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
6-{[3-(ethoxycarbonyl)-4-(4-ethoxyphenyl)thiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Compound characteristics
| Compound ID: | 6049-2262 |
| Compound Name: | 6-{[3-(ethoxycarbonyl)-4-(4-ethoxyphenyl)thiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C23 H25 N O6 S |
| Smiles: | CCOC(c1c(csc1NC(C1CC=CCC1C(O)=O)=O)c1ccc(cc1)OCC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2446 |
| logD: | 1.8888 |
| logSw: | -4.2546 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.33 |
| InChI Key: | OVLDMWSFXNMVLH-UHFFFAOYSA-N |