4-[(3-amino-2-oxo-2H-1-benzopyran-4-yl)amino]benzoic acid
Chemical Structure Depiction of
4-[(3-amino-2-oxo-2H-1-benzopyran-4-yl)amino]benzoic acid
4-[(3-amino-2-oxo-2H-1-benzopyran-4-yl)amino]benzoic acid
Compound characteristics
Compound ID: | 1069-0030 |
Compound Name: | 4-[(3-amino-2-oxo-2H-1-benzopyran-4-yl)amino]benzoic acid |
Molecular Weight: | 296.28 |
Molecular Formula: | C16 H12 N2 O4 |
Smiles: | c1ccc2c(c1)C(=C(C(=O)O2)N)Nc1ccc(cc1)C(O)=O |
Stereo: | ACHIRAL |
logP: | 2.2135 |
logD: | 2.2135 |
logSw: | -3.0373 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 79.787 |
InChI Key: | KDGULBZNHIJHIL-UHFFFAOYSA-N |