3-(5-{5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
Chemical Structure Depiction of
3-(5-{5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
3-(5-{5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid
Compound characteristics
| Compound ID: | 4340-2144 |
| Compound Name: | 3-(5-{5-bromo-1-[(4-methylphenyl)methyl]-2-oxo-1,2-dihydro-3H-indol-3-ylidene}-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)propanoic acid |
| Molecular Weight: | 517.42 |
| Molecular Formula: | C22 H17 Br N2 O4 S2 |
| Smiles: | Cc1ccc(CN2C(C(=C3/C(N(CCC(O)=O)C(=S)S3)=O)/c3cc(ccc23)[Br])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9053 |
| logD: | 1.3727 |
| logSw: | -3.8811 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.545 |
| InChI Key: | KFJFJBLJFZZKTB-UHFFFAOYSA-N |