2-(butylsulfanyl)-3-(3-chloro-4-fluorophenyl)-5-[(2,4-dimethoxyphenyl)methylidene]-3,5-dihydro-4H-imidazol-4-one
Chemical Structure Depiction of
2-(butylsulfanyl)-3-(3-chloro-4-fluorophenyl)-5-[(2,4-dimethoxyphenyl)methylidene]-3,5-dihydro-4H-imidazol-4-one
2-(butylsulfanyl)-3-(3-chloro-4-fluorophenyl)-5-[(2,4-dimethoxyphenyl)methylidene]-3,5-dihydro-4H-imidazol-4-one
Compound characteristics
| Compound ID: | C249-0311 |
| Compound Name: | 2-(butylsulfanyl)-3-(3-chloro-4-fluorophenyl)-5-[(2,4-dimethoxyphenyl)methylidene]-3,5-dihydro-4H-imidazol-4-one |
| Molecular Weight: | 448.94 |
| Molecular Formula: | C22 H22 Cl F N2 O3 S |
| Smiles: | CCCCSC1=NC(=C/c2ccc(cc2OC)OC)\C(N1c1ccc(c(c1)[Cl])F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8726 |
| logD: | 5.8726 |
| logSw: | -5.9866 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.795 |
| InChI Key: | ADERNQQGCZDKHM-UHFFFAOYSA-N |