(2-ethoxy-4-{[4-(ethoxycarbonyl)-5-(4-methylanilino)-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid
Chemical Structure Depiction of
(2-ethoxy-4-{[4-(ethoxycarbonyl)-5-(4-methylanilino)-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid
(2-ethoxy-4-{[4-(ethoxycarbonyl)-5-(4-methylanilino)-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid
Compound characteristics
| Compound ID: | 5648-1268 |
| Compound Name: | (2-ethoxy-4-{[4-(ethoxycarbonyl)-5-(4-methylanilino)-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid |
| Molecular Weight: | 483.54 |
| Molecular Formula: | C25 H25 N O7 S |
| Smiles: | CCOC(C1=C(Nc2ccc(C)cc2)SC(=C/c2ccc(c(c2)OCC)OCC(O)=O)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5663 |
| logD: | 0.3294 |
| logSw: | -4.3666 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.297 |
| InChI Key: | VSKGKASIIBHNHE-UHFFFAOYSA-N |