4-(3-{[(2-{4-[4-(dimethylamino)phenyl]but-3-en-2-ylidene}hydrazinyl)(imino)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoic acid
Chemical Structure Depiction of
4-(3-{[(2-{4-[4-(dimethylamino)phenyl]but-3-en-2-ylidene}hydrazinyl)(imino)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoic acid
4-(3-{[(2-{4-[4-(dimethylamino)phenyl]but-3-en-2-ylidene}hydrazinyl)(imino)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoic acid
Compound characteristics
| Compound ID: | 8007-6829 |
| Compound Name: | 4-(3-{[(2-{4-[4-(dimethylamino)phenyl]but-3-en-2-ylidene}hydrazinyl)(imino)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoic acid |
| Molecular Weight: | 479.56 |
| Molecular Formula: | C24 H25 N5 O4 S |
| Smiles: | C\C(/C=C/c1ccc(cc1)N(C)C)=N/NC(=N)SC1CC(N(C1=O)c1ccc(cc1)C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1017 |
| logD: | 0.7065 |
| logSw: | -3.1443 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.427 |
| InChI Key: | JWNVEWPCHLOLHW-FQEVSTJZSA-N |