3-{3-[(imino{2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl}methyl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoic acid
Chemical Structure Depiction of
3-{3-[(imino{2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl}methyl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoic acid
3-{3-[(imino{2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl}methyl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoic acid
Compound characteristics
| Compound ID: | 8003-0177 |
| Compound Name: | 3-{3-[(imino{2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl}methyl)sulfanyl]-2,5-dioxopyrrolidin-1-yl}benzoic acid |
| Molecular Weight: | 440.48 |
| Molecular Formula: | C21 H20 N4 O5 S |
| Smiles: | C\C(c1ccc(cc1)OC)=N/NC(=N)SC1CC(N(C1=O)c1cccc(c1)C(O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4245 |
| logD: | 2.4245 |
| logSw: | -2.7201 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 105.085 |
| InChI Key: | MDLGMOBLTBEWRB-KRWDZBQOSA-N |