1-(4-butoxyphenyl)-2,5-dioxopyrrolidin-3-yl 2-[(3,4-dihydroxyphenyl)methylidene]hydrazine-1-carboximidothioate
Chemical Structure Depiction of
1-(4-butoxyphenyl)-2,5-dioxopyrrolidin-3-yl 2-[(3,4-dihydroxyphenyl)methylidene]hydrazine-1-carboximidothioate
1-(4-butoxyphenyl)-2,5-dioxopyrrolidin-3-yl 2-[(3,4-dihydroxyphenyl)methylidene]hydrazine-1-carboximidothioate
Compound characteristics
| Compound ID: | 8003-3760 |
| Compound Name: | 1-(4-butoxyphenyl)-2,5-dioxopyrrolidin-3-yl 2-[(3,4-dihydroxyphenyl)methylidene]hydrazine-1-carboximidothioate |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C22 H24 N4 O5 S |
| Smiles: | CCCCOc1ccc(cc1)N1C(CC(C1=O)SC(=N)N/N=C/c1ccc(c(c1)O)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6747 |
| logD: | 1.5282 |
| logSw: | -2.9162 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 110.359 |
| InChI Key: | UFPDTFMODRGZGI-IBGZPJMESA-N |