[5-({1-[(4-nitrophenyl)methyl]-1H-indol-3-yl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
Chemical Structure Depiction of
[5-({1-[(4-nitrophenyl)methyl]-1H-indol-3-yl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
[5-({1-[(4-nitrophenyl)methyl]-1H-indol-3-yl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid
Compound characteristics
| Compound ID: | 3229-2893 |
| Compound Name: | [5-({1-[(4-nitrophenyl)methyl]-1H-indol-3-yl}methylidene)-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid |
| Molecular Weight: | 453.49 |
| Molecular Formula: | C21 H15 N3 O5 S2 |
| Smiles: | C(C(O)=O)N1C(/C(=C\c2cn(Cc3ccc(cc3)[N+]([O-])=O)c3ccccc23)SC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8595 |
| logD: | -0.2595 |
| logSw: | -3.0733 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.211 |
| InChI Key: | XEZIUTUOOZCCSN-UHFFFAOYSA-N |