ethyl 2-(4-methylbenzamido)-4-oxo-5-{[5-(phenylsulfanyl)furan-2-yl]methylidene}-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-(4-methylbenzamido)-4-oxo-5-{[5-(phenylsulfanyl)furan-2-yl]methylidene}-4,5-dihydrothiophene-3-carboxylate
ethyl 2-(4-methylbenzamido)-4-oxo-5-{[5-(phenylsulfanyl)furan-2-yl]methylidene}-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 5648-3211 |
| Compound Name: | ethyl 2-(4-methylbenzamido)-4-oxo-5-{[5-(phenylsulfanyl)furan-2-yl]methylidene}-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 491.58 |
| Molecular Formula: | C26 H21 N O5 S2 |
| Smiles: | CCOC(C1=C(NC(c2ccc(C)cc2)=O)SC(=C/c2ccc(o2)Sc2ccccc2)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4029 |
| logD: | 3.4239 |
| logSw: | -5.8298 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.086 |
| InChI Key: | VYXFSORANRCUQH-UHFFFAOYSA-N |