ethyl 2-anilino-5-({[(4-chlorophenyl)methyl]amino}methylidene)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-anilino-5-({[(4-chlorophenyl)methyl]amino}methylidene)-4-oxo-4,5-dihydrothiophene-3-carboxylate
ethyl 2-anilino-5-({[(4-chlorophenyl)methyl]amino}methylidene)-4-oxo-4,5-dihydrothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3533-0010 |
| Compound Name: | ethyl 2-anilino-5-({[(4-chlorophenyl)methyl]amino}methylidene)-4-oxo-4,5-dihydrothiophene-3-carboxylate |
| Molecular Weight: | 414.91 |
| Molecular Formula: | C21 H19 Cl N2 O3 S |
| Smiles: | CCOC(C1=C(Nc2ccccc2)SC(=C/NCc2ccc(cc2)[Cl])\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.26 |
| logD: | 4.2492 |
| logSw: | -4.4273 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.249 |
| InChI Key: | SSWMJNANLIGKGH-UHFFFAOYSA-N |