TL;DR: 2-(2-Chloro-benzoylamino)-3-hydroxy-butyric acid (CAS 1008206-36-7) is a chemical compound with molecular formula C11H12ClNO4 and molecular weight 257.04547 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(2-chlorobenzoyl)amino]-3-hydroxybutanoic acid
Also Known As: 2-(2-Chloro-benzoylamino)-3-hydroxy-butyric acid, BAS 02748585, 2-[(2-chlorobenzoyl)amino]-3-hydroxybutanoic acid, 2-[(2-chlorophenyl)formamido]-3-hydroxybutanoic acid
| Molecular Formula | C11H12ClNO4 |
| Molecular Weight | 257.04547 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.04547 Da |
| Heavy Atoms | 17 |
| Complexity | 297.0 |
| SMILES | CC(C(C(=O)O)NC(=O)C1=CC=CC=C1Cl)O |
| InChIKey | RCUHLDWTVRKYER-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Chloro-benzoylamino)-3-hydroxy-butyric acid. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Chloro-benzoylamino)-3-hydroxy-butyric acid. Following Lipinski's Rule of Five, 2-(2-Chloro-benzoylamino)-3-hydroxy-butyric acid 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 2-(2-Chloro-benzoylamino)-3-hydroxy-butyric acid is 1008206-36-7.
The molecular formula of 2-(2-Chloro-benzoylamino)-3-hydroxy-butyric acid is C11H12ClNO4.
The molecular weight of 2-(2-Chloro-benzoylamino)-3-hydroxy-butyric acid is 257.04547 g/mol.
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