异硬脂酰胺基丙基烷基二甲基氯化铵
TL;DR: 异硬脂酰胺基丙基烷基二甲基氯化铵 (CAS 67633-59-4) is a chemical compound with molecular formula C30H55ClN2O and molecular weight 494.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异硬脂酰胺基丙基烷基二甲基氯化铵
benzyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium chloride
Also Known As: Isostearaminopropalkonium chloride, ISOSTEARAMINOPROPALKONIUM CHLORIDE [INCI], Benzyldimethyl(3-((1-oxoisooctadecyl)amino)propyl)ammonium chloride, N-(3-Isostearylamido)propyl-N,N-dimethyl-N-benzylammonium chloride, benzyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium;chloride
| Molecular Formula | C30H55ClN2O |
|---|---|
| Molecular Weight | 494.40 g/mol |
| LogP | 4.89 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 21 |
| Exact Mass | 494.4003 |
| Heavy Atoms | 34 |
| Complexity | 454.0 |
Chemical Identifiers
| CAS Number | 67633-59-4 |
|---|---|
| SMILES | CC(C)CCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC1=CC=CC=C1.[Cl-] |
| InChIKey | NXQFUHDNRBQQAE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
异硬脂酰胺基丙基烷基二甲基氯化铵 (CAS 67633-59-4), with molecular formula C30H55ClN2O and molecular weight 494.40 g/mol. IUPAC: benzyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium chloride.
Chemical Property Profile of 异硬脂酰胺基丙基烷基二甲基氯化铵
Property Insights of 异硬脂酰胺基丙基烷基二甲基氯化铵
The XLogP value of 4.89 indicates that 异硬脂酰胺基丙基烷基二甲基氯化铵 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 异硬脂酰胺基丙基烷基二甲基氯化铵 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 异硬脂酰胺基丙基烷基二甲基氯化铵 has 1 hydrogen bond donor(s) and 2 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 异硬脂酰胺基丙基烷基二甲基氯化铵?
The CAS number of 异硬脂酰胺基丙基烷基二甲基氯化铵 is 67633-59-4.
What is the molecular formula of 异硬脂酰胺基丙基烷基二甲基氯化铵?
The molecular formula of 异硬脂酰胺基丙基烷基二甲基氯化铵 is C30H55ClN2O.
What is the molecular weight of 异硬脂酰胺基丙基烷基二甲基氯化铵?
The molecular weight of 异硬脂酰胺基丙基烷基二甲基氯化铵 is 494.40 g/mol.
Where can I buy 异硬脂酰胺基丙基烷基二甲基氯化铵?
You can request a quote for 异硬脂酰胺基丙基烷基二甲基氯化铵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异硬脂酰胺基丙基烷基二甲基氯化铵?
Yes, KEHONG BIO provides custom synthesis services for 异硬脂酰胺基丙基烷基二甲基氯化铵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.