Pentamoxane
TL;DR: Pentamoxane (CAS 4730-07-8) is a chemical compound with molecular formula C14H21NO2 and molecular weight 235.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-methylbutan-1-amine
Also Known As: PENTAMOXANE, pentamoxano, Pentamoxane [INN], pentamoxanum, 2-ISOPENTYLAMINOMETHYL-1,4-BENZODIOXANE
| Molecular Formula | C14H21NO2 |
|---|---|
| Molecular Weight | 235.16 g/mol |
| LogP | 2.4621 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 235.15723 |
| Heavy Atoms | 17 |
| Complexity | 351.83038 |
Chemical Identifiers
| CAS Number | 4730-07-8 |
|---|---|
| SMILES | CC(C)CCNCC1COC2=CC=CC=C2O1 |
Product Overview
Pentamoxane (CAS 4730-07-8), with molecular formula C14H21NO2 and molecular weight 235.16 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-3-methylbutan-1-amine.
Chemical Property Profile of Pentamoxane
Property Insights of Pentamoxane
The XLogP value of 2.4621 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentamoxane. With a topological polar surface area (TPSA) of 30.49 Ų, Pentamoxane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentamoxane has 1 hydrogen bond donor(s) and 3 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 Pentamoxane?
The CAS number of Pentamoxane is 4730-07-8.
What is the molecular formula of Pentamoxane?
The molecular formula of Pentamoxane is C14H21NO2.
What is the molecular weight of Pentamoxane?
The molecular weight of Pentamoxane is 235.16 g/mol.
Where can I buy Pentamoxane?
You can request a quote for Pentamoxane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentamoxane?
Yes, KEHONG BIO provides custom synthesis services for Pentamoxane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.