(2-{[4-(ethoxycarbonyl)-5-(4-ethylanilino)-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid
Chemical Structure Depiction of
(2-{[4-(ethoxycarbonyl)-5-(4-ethylanilino)-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid
(2-{[4-(ethoxycarbonyl)-5-(4-ethylanilino)-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid
Compound characteristics
| Compound ID: | 4767-1266 |
| Compound Name: | (2-{[4-(ethoxycarbonyl)-5-(4-ethylanilino)-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid |
| Molecular Weight: | 453.51 |
| Molecular Formula: | C24 H23 N O6 S |
| Smiles: | CCc1ccc(cc1)NC1=C(C(/C(=C/c2ccccc2OCC(O)=O)S1)=O)C(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 5.6274 |
| logD: | 1.3904 |
| logSw: | -5.4081 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.087 |
| InChI Key: | BGMHGGKWVFWUBH-UHFFFAOYSA-N |