Octenidine Hydrochloride
TL;DR: Octenidine Hydrochloride (CAS 70775-75-6) is a chemical compound with molecular formula C36H64Cl2N4 and molecular weight 622.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-octyl-1-[10-(4-octylimino-1-pyridinyl)decyl]pyridin-4-imine;dihydrochloride
Also Known As: Octenidine dihydrochloride, OCTENIDINE HYDROCHLORIDE, Octenidine HCl, Sensidin do, octeniderm
| Molecular Formula | C36H64Cl2N4 |
|---|---|
| Molecular Weight | 622.45 g/mol |
| LogP | 10.48 |
| Topological Polar Surface Area | 31.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 25 |
| Exact Mass | 622.4508 |
| Heavy Atoms | 42 |
| Complexity | 691.0 |
Chemical Identifiers
| CAS Number | 70775-75-6 |
|---|---|
| SMILES | CCCCCCCCN=C1C=CN(C=C1)CCCCCCCCCCN2C=CC(=NCCCCCCCC)C=C2.Cl.Cl |
| InChIKey | SMGTYJPMKXNQFY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octenidine Hydrochloride (CAS 70775-75-6), with molecular formula C36H64Cl2N4 and molecular weight 622.45 g/mol. IUPAC: N-octyl-1-[10-(4-octylimino-1-pyridinyl)decyl]pyridin-4-imine;dihydrochloride.
Chemical Property Profile of Octenidine Hydrochloride
Property Insights of Octenidine Hydrochloride
The XLogP value of 10.48 indicates that Octenidine Hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 31.2 Ų, Octenidine Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octenidine Hydrochloride has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octenidine Hydrochloride?
The CAS number of Octenidine Hydrochloride is 70775-75-6.
What is the molecular formula of Octenidine Hydrochloride?
The molecular formula of Octenidine Hydrochloride is C36H64Cl2N4.
What is the molecular weight of Octenidine Hydrochloride?
The molecular weight of Octenidine Hydrochloride is 622.45 g/mol.
Where can I buy Octenidine Hydrochloride?
You can request a quote for Octenidine Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octenidine Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Octenidine Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.