ethyl 2-anilino-5-{[2-(benzyloxy)phenyl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-anilino-5-{[2-(benzyloxy)phenyl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-anilino-5-{[2-(benzyloxy)phenyl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
Compound ID: | 5784-0090 |
Compound Name: | ethyl 2-anilino-5-{[2-(benzyloxy)phenyl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate |
Molecular Weight: | 457.55 |
Molecular Formula: | C27 H23 N O4 S |
Smiles: | CCOC(C1=C(Nc2ccccc2)SC(=C/c2ccccc2OCc2ccccc2)\C1=O)=O |
Stereo: | ACHIRAL |
logP: | 6.6296 |
logD: | 6.6181 |
logSw: | -5.8122 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.431 |
InChI Key: | RDWMATFWWCLKHO-UHFFFAOYSA-N |