ethyl 2-(4-methylbenzamido)-4-oxo-5-(3-phenylprop-2-en-1-ylidene)-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-methylbenzamido)-4-oxo-5-(3-phenylprop-2-en-1-ylidene)-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(4-methylbenzamido)-4-oxo-5-(3-phenylprop-2-en-1-ylidene)-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
Compound ID: | 5648-3142 |
Compound Name: | ethyl 2-(4-methylbenzamido)-4-oxo-5-(3-phenylprop-2-en-1-ylidene)-4,5-dihydrothiophene-3-carboxylate |
Molecular Weight: | 419.5 |
Molecular Formula: | C24 H21 N O4 S |
Smiles: | CCOC(C1=C(NC(c2ccc(C)cc2)=O)SC(=C/C=C/c2ccccc2)\C1=O)=O |
Stereo: | ACHIRAL |
logP: | 5.3687 |
logD: | 1.3342 |
logSw: | -5.496 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.296 |
InChI Key: | DYFVPBLWIUAGSP-UHFFFAOYSA-N |