Axamozide
TL;DR: Axamozide (CAS 85076-06-8) is a chemical compound with molecular formula C21H22ClN3O3 and molecular weight 399.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]-1H-benzimidazol-2-one
Also Known As: Axamozide, Axamozidum, Axamozide [INN], axamozida, (+-)-1-(1-(1,4-benzodioxan-2-ylmethyl)-4-piperidyl)-5-chloro-2-benzimidazolinone
| Molecular Formula | C21H22ClN3O3 |
|---|---|
| Molecular Weight | 399.13 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 399.13498 |
| Heavy Atoms | 28 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 85076-06-8 |
|---|---|
| SMILES | C1CN(CCC1N2C3=C(C=C(C=C3)Cl)NC2=O)CC4COC5=CC=CC=C5O4 |
| InChIKey | WFJWTVCUKPPEOR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Axamozide (CAS 85076-06-8), with molecular formula C21H22ClN3O3 and molecular weight 399.13 g/mol. IUPAC: 6-chloro-3-[1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)piperidin-4-yl]-1H-benzimidazol-2-one.
Chemical Property Profile of Axamozide
Property Insights of Axamozide
The XLogP value of 4.7 indicates that Axamozide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, Axamozide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Axamozide has 1 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 Axamozide?
The CAS number of Axamozide is 85076-06-8.
What is the molecular formula of Axamozide?
The molecular formula of Axamozide is C21H22ClN3O3.
What is the molecular weight of Axamozide?
The molecular weight of Axamozide is 399.13 g/mol.
Where can I buy Axamozide?
You can request a quote for Axamozide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Axamozide?
Yes, KEHONG BIO provides custom synthesis services for Axamozide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.