4-(3-{[(2-{[4-(dimethylamino)phenyl]methylidene}hydrazinyl)(imino)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoic acid
Chemical Structure Depiction of
4-(3-{[(2-{[4-(dimethylamino)phenyl]methylidene}hydrazinyl)(imino)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoic acid
4-(3-{[(2-{[4-(dimethylamino)phenyl]methylidene}hydrazinyl)(imino)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoic acid
Compound characteristics
| Compound ID: | 4143-0062 |
| Compound Name: | 4-(3-{[(2-{[4-(dimethylamino)phenyl]methylidene}hydrazinyl)(imino)methyl]sulfanyl}-2,5-dioxopyrrolidin-1-yl)benzoic acid |
| Molecular Weight: | 439.49 |
| Molecular Formula: | C21 H21 N5 O4 S |
| Smiles: | CN(C)c1ccc(/C=N/NC(=N)SC2CC(N(C2=O)c2ccc(cc2)C(O)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1242 |
| logD: | 2.1242 |
| logSw: | -2.7816 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.058 |
| InChI Key: | PRERIIVEYVKJRU-KRWDZBQOSA-N |