2-[(9,10-dioxo-9,10-dihydroanthracene-2-sulfonyl)amino]benzoic acid
Chemical Structure Depiction of
2-[(9,10-dioxo-9,10-dihydroanthracene-2-sulfonyl)amino]benzoic acid
2-[(9,10-dioxo-9,10-dihydroanthracene-2-sulfonyl)amino]benzoic acid
Compound characteristics
Compound ID: | 6144-0260 |
Compound Name: | 2-[(9,10-dioxo-9,10-dihydroanthracene-2-sulfonyl)amino]benzoic acid |
Molecular Weight: | 407.4 |
Molecular Formula: | C21 H13 N O6 S |
Smiles: | c1ccc2C(c3cc(ccc3C(c2c1)=O)S(Nc1ccccc1C(O)=O)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.415 |
logD: | -0.1797 |
logSw: | -4.2967 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 94.54 |
InChI Key: | LBBSTUFZLPYFGT-UHFFFAOYSA-N |