RefChem:327882
TL;DR: RefChem:327882 (CAS 69781-32-4) is a chemical compound with molecular formula C18H31ClN2O2 and molecular weight 342.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-aminobenzoyl)oxyethyl-(2,6-dimethylheptan-4-yl)azanium chloride
Also Known As: Benzoic acid, p-amino-, 2-((1-isobutyl-3-methylbutyl)amino)ethyl ester, hydrochloride, p-Aminobenzoic acid 2-((1-isobutyl-3-methylbutyl)amino)ethyl ester hydrochloride, 2-(4-aminobenzoyl)oxyethyl-(2,6-dimethylheptan-4-yl)azanium chloride, RefChem:327882
| Molecular Formula | C18H31ClN2O2 |
|---|---|
| Molecular Weight | 342.21 g/mol |
| LogP | -0.55 |
| Topological Polar Surface Area | 68.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 342.2074 |
| Heavy Atoms | 23 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 69781-32-4 |
|---|---|
| SMILES | CC(C)CC(CC(C)C)[NH2+]CCOC(=O)C1=CC=C(C=C1)N.[Cl-] |
| InChIKey | PTOYXJNQESEOPE-UHFFFAOYSA-N |
Product Overview
RefChem:327882 (CAS 69781-32-4), with molecular formula C18H31ClN2O2 and molecular weight 342.21 g/mol. IUPAC: 2-(4-aminobenzoyl)oxyethyl-(2,6-dimethylheptan-4-yl)azanium chloride.
Chemical Property Profile of RefChem:327882
Property Insights of RefChem:327882
The XLogP value of -0.55 indicates that RefChem:327882 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:327882. Following Lipinski's Rule of Five, RefChem:327882 has 2 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 RefChem:327882?
The CAS number of RefChem:327882 is 69781-32-4.
What is the molecular formula of RefChem:327882?
The molecular formula of RefChem:327882 is C18H31ClN2O2.
What is the molecular weight of RefChem:327882?
The molecular weight of RefChem:327882 is 342.21 g/mol.
Where can I buy RefChem:327882?
You can request a quote for RefChem:327882 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:327882?
Yes, KEHONG BIO provides custom synthesis services for RefChem:327882 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.