4-{[5-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-3-(prop-2-en-1-yl)-1,3-thiazolidin-2-ylidene]amino}benzoic acid
Chemical Structure Depiction of
4-{[5-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-3-(prop-2-en-1-yl)-1,3-thiazolidin-2-ylidene]amino}benzoic acid
4-{[5-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-3-(prop-2-en-1-yl)-1,3-thiazolidin-2-ylidene]amino}benzoic acid
Compound characteristics
| Compound ID: | 6194-0129 |
| Compound Name: | 4-{[5-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-3-(prop-2-en-1-yl)-1,3-thiazolidin-2-ylidene]amino}benzoic acid |
| Molecular Weight: | 484.33 |
| Molecular Formula: | C21 H14 Br N3 O4 S |
| Smiles: | C=CCN1\C(=N/c2ccc(cc2)C(O)=O)SC(=C2C(Nc3ccc(cc\23)[Br])=O)\C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.2757 |
| logD: | 0.8856 |
| logSw: | -4.2396 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.766 |
| InChI Key: | BHMGCBJQRRFNOD-UHFFFAOYSA-N |