ethyl 5-{[4-(dimethylamino)phenyl]methylidene}-2-(2-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{[4-(dimethylamino)phenyl]methylidene}-2-(2-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 5-{[4-(dimethylamino)phenyl]methylidene}-2-(2-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | V022-0044 |
| Compound Name: | ethyl 5-{[4-(dimethylamino)phenyl]methylidene}-2-(2-methoxyanilino)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 424.52 |
| Molecular Formula: | C23 H24 N2 O4 S |
| Salt: | not_available |
| Smiles: | CCOC(C1=C(Nc2ccccc2OC)SC(=C\c2ccc(cc2)N(C)C)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.085 |
| logD: | 4.841 |
| logSw: | -4.8212 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.854 |
| InChI Key: | ISQMCPSVQRSKSV-UHFFFAOYSA-N |