Olopatadine N-oxide
TL;DR: Olopatadine N-oxide (CAS 1246832-94-9) is a chemical compound with molecular formula C21H23NO4 and molecular weight 353.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-[2-(carboxymethyl)-6H-benzo[c][1]benzoxepin-11-ylidene]-N,N-dimethylpropan-1-amine oxide
Also Known As: Olopatadine N-Oxide, Olopatadine related compound B, OLOPATADINE (M3), Olopatadine USP RC B, Olopatadine-d3 N-Oxide
| Molecular Formula | C21H23NO4 |
|---|---|
| Molecular Weight | 353.16 g/mol |
| LogP | 3.6021 |
| Topological Polar Surface Area | 69.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 353.16272 |
| Heavy Atoms | 26 |
| Complexity | 849.32983 |
Chemical Identifiers
| CAS Number | 1246832-94-9 |
|---|---|
| SMILES | C[N+](C)(CC/C=C\1/C2=CC=CC=C2COC3=C1C=C(C=C3)CC(=O)O)[O-] |
Product Overview
Olopatadine N-oxide (CAS 1246832-94-9), with molecular formula C21H23NO4 and molecular weight 353.16 g/mol. IUPAC: (3Z)-3-[2-(carboxymethyl)-6H-benzo[c][1]benzoxepin-11-ylidene]-N,N-dimethylpropan-1-amine oxide.
Chemical Property Profile of Olopatadine N-oxide
Property Insights of Olopatadine N-oxide
The XLogP value of 3.6021 indicates that Olopatadine N-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.59 Ų falls within the moderate polarity range, balancing permeability and solubility for Olopatadine N-oxide. Following Lipinski's Rule of Five, Olopatadine N-oxide 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 Olopatadine N-oxide?
The CAS number of Olopatadine N-oxide is 1246832-94-9.
What is the molecular formula of Olopatadine N-oxide?
The molecular formula of Olopatadine N-oxide is C21H23NO4.
What is the molecular weight of Olopatadine N-oxide?
The molecular weight of Olopatadine N-oxide is 353.16 g/mol.
Where can I buy Olopatadine N-oxide?
You can request a quote for Olopatadine N-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Olopatadine N-oxide?
Yes, KEHONG BIO provides custom synthesis services for Olopatadine N-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.