TL;DR: Benzoic acid, 2-amino-5-bromo-4-chloro-3-hydroxy- (CAS 149517-73-7) is a chemical compound with molecular formula C7H5BrClNO3 and molecular weight 264.91412 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-5-bromo-4-chloro-3-hydroxybenzoic acid
Also Known As: 2-amino-5-bromo-4-chloro-3-hydroxybenzoic acid, Benzoic acid, 2-amino-5-bromo-4-chloro-3-hydroxy-, 3-Hydroxy-4-chloro-5-bromoanthanilic acid, J1.182.616D, 2-amino-5-bromo-4-chloro-3-hydroxy-benzoic Acid
| Molecular Formula | C7H5BrClNO3 |
| Molecular Weight | 264.91412 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 83.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 264.91412 Da |
| Heavy Atoms | 13 |
| Complexity | 216.0 |
| SMILES | C1=C(C(=C(C(=C1Br)Cl)O)N)C(=O)O |
| InChIKey | WUTOGJGZLKLSJI-UHFFFAOYSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2-amino-5-bromo-4-chloro-3-hydroxy-. The TPSA of 83.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2-amino-5-bromo-4-chloro-3-hydroxy-. Following Lipinski's Rule of Five, Benzoic acid, 2-amino-5-bromo-4-chloro-3-hydroxy- has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzoic acid, 2-amino-5-bromo-4-chloro-3-hydroxy- is 149517-73-7.
The molecular formula of Benzoic acid, 2-amino-5-bromo-4-chloro-3-hydroxy- is C7H5BrClNO3.
The molecular weight of Benzoic acid, 2-amino-5-bromo-4-chloro-3-hydroxy- is 264.91412 g/mol.
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