ethyl 4-{2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-[(2-methylphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-[(2-methylphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}benzoate
ethyl 4-{2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-[(2-methylphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}benzoate
Compound characteristics
| Compound ID: | C249-0571 |
| Compound Name: | ethyl 4-{2-[(2-ethoxy-2-oxoethyl)sulfanyl]-4-[(2-methylphenyl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-1-yl}benzoate |
| Molecular Weight: | 452.53 |
| Molecular Formula: | C24 H24 N2 O5 S |
| Smiles: | CCOC(CSC1=NC(=C/c2ccccc2C)\C(N1c1ccc(cc1)C(=O)OCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7203 |
| logD: | 4.7203 |
| logSw: | -4.4759 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 66.534 |
| InChI Key: | XQQMJCQHVMAZMI-UHFFFAOYSA-N |