(2-{[5-(4-ethoxyanilino)-4-(ethoxycarbonyl)-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid
Chemical Structure Depiction of
(2-{[5-(4-ethoxyanilino)-4-(ethoxycarbonyl)-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid
(2-{[5-(4-ethoxyanilino)-4-(ethoxycarbonyl)-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid
Compound characteristics
| Compound ID: | 4767-1319 |
| Compound Name: | (2-{[5-(4-ethoxyanilino)-4-(ethoxycarbonyl)-3-oxothiophen-2(3H)-ylidene]methyl}phenoxy)acetic acid |
| Molecular Weight: | 469.51 |
| Molecular Formula: | C24 H23 N O7 S |
| Smiles: | CCOC(C1=C(Nc2ccc(cc2)OCC)SC(=C/c2ccccc2OCC(O)=O)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0657 |
| logD: | 0.8287 |
| logSw: | -4.4754 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.21 |
| InChI Key: | BNRGYZKBNZTIQH-UHFFFAOYSA-N |