J294.579G
2-[6-(6-methyl-7-sulfo-1,3-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxoindene-5-carboxylic acid
Also Known As: 2-[6-(6-methyl-7-sulfo-1,3-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxoindene-5-carboxylic acid|2-[6-(6-methyl-7-sulfo-1,3-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxo-2,3-dihydro-1H-indene-5-carboxylic acid|1,3-Dioxo-2-[6-(6-methyl-7-sulfo-2-benzothiazolyl)-2-quinolinyl]-2,3-dihydro-1H-indene-5-carboxylic acid|2,3-Dihydro-2-[6-(6-methyl-7-sulfo-2-benzothiazolyl)-2-quinolinyl]-1,3-dioxo-1H-indene-5-carboxylic acid|2-[6-(6-methyl-7-sulfo-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxo-indene-5-carboxylic Acid
| Molecular Formula | C27H16N2O7S2 |
|---|---|
| Molecular Weight | 544.0399 g/mol |
| LogP | 4.93 |
| Topological Polar Surface Area | 151.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 544.0399 |
| Heavy Atoms | 38 |
| Complexity | 1994.2 |
Chemical Identifiers
| CAS Number | 65151-70-4 |
|---|---|
| SMILES | CC1=C(C2=C(C=C1)N=C(S2)C3=CC4=C(C=C3)N=C(C=C4)C5C(=O)C6=C(C5=O)C=C(C=C6)C(=O)O)S(=O)(=O)O |
Product Overview
J294.579G (CAS 65151-70-4), with molecular formula C27H16N2O7S2 and molecular weight 544.0399 g/mol. IUPAC: 2-[6-(6-methyl-7-sulfo-1,3-benzothiazol-2-yl)quinolin-2-yl]-1,3-dioxoindene-5-carboxylic acid.
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