4-(2-Chloroacetamido)-3-phenylbutanoic acid
TL;DR: 4-(2-Chloroacetamido)-3-phenylbutanoic acid (CAS 318271-36-2) is a chemical compound with molecular formula C12H14ClNO3 and molecular weight 255.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(2-chloroacetyl)amino]-3-phenylbutanoic acid
Also Known As: 4-[(2-chloroacetyl)amino]-3-phenylbutanoic acid, 4-[(2-chloroacetyl)amino]-3-phenyl-butanoic Acid, 4-(2-CHLOROACETAMIDO)-3-PHENYLBUTANOIC ACID
| Molecular Formula | C12H14ClNO3 |
|---|---|
| Molecular Weight | 255.07 g/mol |
| LogP | 1.5999 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 255.06622 |
| Heavy Atoms | 17 |
| Complexity | 380.59695 |
Chemical Identifiers
| CAS Number | 318271-36-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(CC(=O)O)CNC(=O)CCl |
Product Overview
4-(2-Chloroacetamido)-3-phenylbutanoic acid (CAS 318271-36-2), with molecular formula C12H14ClNO3 and molecular weight 255.07 g/mol. IUPAC: 4-[(2-chloroacetyl)amino]-3-phenylbutanoic acid.
Chemical Property Profile of 4-(2-Chloroacetamido)-3-phenylbutanoic acid
Property Insights of 4-(2-Chloroacetamido)-3-phenylbutanoic acid
The XLogP value of 1.5999 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Chloroacetamido)-3-phenylbutanoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Chloroacetamido)-3-phenylbutanoic acid. Following Lipinski's Rule of Five, 4-(2-Chloroacetamido)-3-phenylbutanoic acid has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(2-Chloroacetamido)-3-phenylbutanoic acid?
The CAS number of 4-(2-Chloroacetamido)-3-phenylbutanoic acid is 318271-36-2.
What is the molecular formula of 4-(2-Chloroacetamido)-3-phenylbutanoic acid?
The molecular formula of 4-(2-Chloroacetamido)-3-phenylbutanoic acid is C12H14ClNO3.
What is the molecular weight of 4-(2-Chloroacetamido)-3-phenylbutanoic acid?
The molecular weight of 4-(2-Chloroacetamido)-3-phenylbutanoic acid is 255.07 g/mol.
Where can I buy 4-(2-Chloroacetamido)-3-phenylbutanoic acid?
You can request a quote for 4-(2-Chloroacetamido)-3-phenylbutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Chloroacetamido)-3-phenylbutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Chloroacetamido)-3-phenylbutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.