2-{5-[(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoic acid
Chemical Structure Depiction of
2-{5-[(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoic acid
2-{5-[(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoic acid
Compound characteristics
Compound ID: | 3229-2309 |
Compound Name: | 2-{5-[(4-oxo-3-phenyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]furan-2-yl}benzoic acid |
Molecular Weight: | 407.47 |
Molecular Formula: | C21 H13 N O4 S2 |
Smiles: | C(=C1/C(N(C(=S)S1)c1ccccc1)=O)/c1ccc(c2ccccc2C(O)=O)o1 |
Stereo: | ACHIRAL |
logP: | 4.401 |
logD: | 0.3481 |
logSw: | -4.3324 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.809 |
InChI Key: | WFBHPOADSUFDHU-UHFFFAOYSA-N |