RefChem:327805
TL;DR: RefChem:327805 (CAS 3737-72-2) is a chemical compound with molecular formula C23H32ClNO4 and molecular weight 421.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-[2-[4-(4-methoxyphenoxy)carbonylphenoxy]pentyl]azanium chloride
Also Known As: U-0290, p-(2-((Diethylamino)methyl)butoxy)benzoic acid p-methoxyphenyl ester hydrochloride, Benzoic acid, p-(2-((diethylamino)methyl)butoxy)-, p-methoxyphenyl ester, hydrochloride, diethyl-[2-[4-(4-methoxyphenoxy)carbonylphenoxy]pentyl]azanium chloride
| Molecular Formula | C23H32ClNO4 |
|---|---|
| Molecular Weight | 421.20 g/mol |
| LogP | 0.39 |
| Topological Polar Surface Area | 49.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 421.202 |
| Heavy Atoms | 29 |
| Complexity | 424.0 |
Chemical Identifiers
| CAS Number | 3737-72-2 |
|---|---|
| SMILES | CCCC(C[NH+](CC)CC)OC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC.[Cl-] |
| InChIKey | IJIPNXUKJDCYFM-UHFFFAOYSA-N |
Product Overview
RefChem:327805 (CAS 3737-72-2), with molecular formula C23H32ClNO4 and molecular weight 421.20 g/mol. IUPAC: diethyl-[2-[4-(4-methoxyphenoxy)carbonylphenoxy]pentyl]azanium chloride.
Chemical Property Profile of RefChem:327805
Property Insights of RefChem:327805
The XLogP value of 0.39 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:327805. With a topological polar surface area (TPSA) of 49.2 Ų, RefChem:327805 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:327805 has 1 hydrogen bond donor(s) and 5 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:327805?
The CAS number of RefChem:327805 is 3737-72-2.
What is the molecular formula of RefChem:327805?
The molecular formula of RefChem:327805 is C23H32ClNO4.
What is the molecular weight of RefChem:327805?
The molecular weight of RefChem:327805 is 421.20 g/mol.
Where can I buy RefChem:327805?
You can request a quote for RefChem:327805 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:327805?
Yes, KEHONG BIO provides custom synthesis services for RefChem:327805 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.