3-{5-[(2-carbamothioylhydrazinylidene)methyl]furan-2-yl}benzoic acid
Chemical Structure Depiction of
3-{5-[(2-carbamothioylhydrazinylidene)methyl]furan-2-yl}benzoic acid
3-{5-[(2-carbamothioylhydrazinylidene)methyl]furan-2-yl}benzoic acid
Compound characteristics
Compound ID: | 5552-0653 |
Compound Name: | 3-{5-[(2-carbamothioylhydrazinylidene)methyl]furan-2-yl}benzoic acid |
Molecular Weight: | 289.31 |
Molecular Formula: | C13 H11 N3 O3 S |
Smiles: | C(\c1ccc(c2cccc(c2)C(O)=O)o1)=N/NC(N)=S |
Stereo: | ACHIRAL |
logP: | 3.1659 |
logD: | -0.3468 |
logSw: | -3.3362 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 78.025 |
InChI Key: | YAAQQGFFRHANNZ-UHFFFAOYSA-N |