methyl 2-anilino-5-{[4-(diethylamino)phenyl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
methyl 2-anilino-5-{[4-(diethylamino)phenyl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate
methyl 2-anilino-5-{[4-(diethylamino)phenyl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4302-2421 |
| Compound Name: | methyl 2-anilino-5-{[4-(diethylamino)phenyl]methylidene}-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 408.52 |
| Molecular Formula: | C23 H24 N2 O3 S |
| Smiles: | CCN(CC)c1ccc(/C=C2/C(C(=C(Nc3ccccc3)S2)C(=O)OC)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0289 |
| logD: | 5.0156 |
| logSw: | -4.6257 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.273 |
| InChI Key: | LUFOURYCCQDSFZ-UHFFFAOYSA-N |