5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid
TL;DR: 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid (CAS 385375-11-1) is a chemical compound with molecular formula C10H9Cl2NO4 and molecular weight 276.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-3-[[(2-chloroacetyl)amino]methyl]-2-hydroxybenzoic acid
Also Known As: 5-chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid, 5-chloro-3-[[(2-chloroacetyl)amino]methyl]-2-hydroxybenzoic acid, 5-Chloro-3-([(chloroacetyl)amino]methyl)-2-hydroxybenzoic acid, 5-Chloro-3-((2-chloroacetamido)methyl)-2-hydroxybenzoic acid, 5-CHLORO-3-[(2-CHLOROACETAMIDO)METHYL]-2-HYDROXYBENZOIC ACID
| Molecular Formula | C10H9Cl2NO4 |
|---|---|
| Molecular Weight | 276.99 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.99088 |
| Heavy Atoms | 17 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 385375-11-1 |
|---|---|
| SMILES | C1=C(C=C(C(=C1CNC(=O)CCl)O)C(=O)O)Cl |
| InChIKey | XKTSSODRPLWKRS-UHFFFAOYSA-N |
Product Overview
5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid (CAS 385375-11-1), with molecular formula C10H9Cl2NO4 and molecular weight 276.99 g/mol. IUPAC: 5-chloro-3-[[(2-chloroacetyl)amino]methyl]-2-hydroxybenzoic acid.
Chemical Property Profile of 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid
Property Insights of 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid. Following Lipinski's Rule of Five, 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid has 3 hydrogen bond donor(s) and 4 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 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid?
The CAS number of 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid is 385375-11-1.
What is the molecular formula of 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid?
The molecular formula of 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid is C10H9Cl2NO4.
What is the molecular weight of 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid?
The molecular weight of 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid is 276.99 g/mol.
Where can I buy 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid?
You can request a quote for 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloro-3-{[(chloroacetyl)amino]methyl}-2-hydroxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.