2-[(4-chlorophenyl)carbamoyl]-3-nitrobenzoic acid
Chemical Structure Depiction of
2-[(4-chlorophenyl)carbamoyl]-3-nitrobenzoic acid
2-[(4-chlorophenyl)carbamoyl]-3-nitrobenzoic acid
Compound characteristics
Compound ID: | 3285-0229 |
Compound Name: | 2-[(4-chlorophenyl)carbamoyl]-3-nitrobenzoic acid |
Molecular Weight: | 320.69 |
Molecular Formula: | C14 H9 Cl N2 O5 |
Smiles: | c1cc(C(O)=O)c(C(Nc2ccc(cc2)[Cl])=O)c(c1)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 3.1531 |
logD: | -1.7152 |
logSw: | -3.8777 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 84.818 |
InChI Key: | PKXMKANXITUNGQ-UHFFFAOYSA-N |