3-[2-(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamido]benzoic acid
Chemical Structure Depiction of
3-[2-(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamido]benzoic acid
3-[2-(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamido]benzoic acid
Compound characteristics
Compound ID: | 8018-5785 |
Compound Name: | 3-[2-(6-chloro-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)acetamido]benzoic acid |
Molecular Weight: | 360.75 |
Molecular Formula: | C17 H13 Cl N2 O5 |
Smiles: | C(C(Nc1cccc(c1)C(O)=O)=O)N1C(COc2ccc(cc12)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 2.8674 |
logD: | -0.0185 |
logSw: | -3.3134 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 75.626 |
InChI Key: | LKMGTRNAOHOJSO-UHFFFAOYSA-N |