3-[(4-chlorobenzene-1-sulfonyl)amino]-3-(2-chloro-5-nitrophenyl)propanoic acid
Chemical Structure Depiction of
3-[(4-chlorobenzene-1-sulfonyl)amino]-3-(2-chloro-5-nitrophenyl)propanoic acid
3-[(4-chlorobenzene-1-sulfonyl)amino]-3-(2-chloro-5-nitrophenyl)propanoic acid
Compound characteristics
| Compound ID: | 8016-1210 |
| Compound Name: | 3-[(4-chlorobenzene-1-sulfonyl)amino]-3-(2-chloro-5-nitrophenyl)propanoic acid |
| Molecular Weight: | 419.24 |
| Molecular Formula: | C15 H12 Cl2 N2 O6 S |
| Smiles: | C(C(c1cc(ccc1[Cl])[N+]([O-])=O)NS(c1ccc(cc1)[Cl])(=O)=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7545 |
| logD: | 0.9536 |
| logSw: | -4.0318 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.606 |
| InChI Key: | QSCQWWPDKWZJQK-AWEZNQCLSA-N |