3-({4-chloro-3-[(2-nitrophenyl)carbamoyl]benzene-1-sulfonyl}amino)benzoic acid
Chemical Structure Depiction of
3-({4-chloro-3-[(2-nitrophenyl)carbamoyl]benzene-1-sulfonyl}amino)benzoic acid
3-({4-chloro-3-[(2-nitrophenyl)carbamoyl]benzene-1-sulfonyl}amino)benzoic acid
Compound characteristics
| Compound ID: | 0868-0171 |
| Compound Name: | 3-({4-chloro-3-[(2-nitrophenyl)carbamoyl]benzene-1-sulfonyl}amino)benzoic acid |
| Molecular Weight: | 475.86 |
| Molecular Formula: | C20 H14 Cl N3 O7 S |
| Smiles: | c1ccc(c(c1)NC(c1cc(ccc1[Cl])S(Nc1cccc(c1)C(O)=O)(=O)=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5133 |
| logD: | 1.7632 |
| logSw: | -4.5489 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 124.77 |
| InChI Key: | CAKQNVDMKAZFRN-UHFFFAOYSA-N |