4-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione
Chemical Structure Depiction of
4-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione
4-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione
Compound characteristics
| Compound ID: | 5752-0144 |
| Compound Name: | 4-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)methylidene]-1-(3-methylphenyl)pyrazolidine-3,5-dione |
| Molecular Weight: | 362.39 |
| Molecular Formula: | C20 H18 N4 O3 |
| Smiles: | Cc1cccc(c1)N1C(C(=C/c2ccc3c(c2)N(C)C(N3C)=O)\C(N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3704 |
| logD: | 2.1839 |
| logSw: | -2.7773 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.444 |
| InChI Key: | JPCUPMBITRYQFM-UHFFFAOYSA-N |