Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride
TL;DR: Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride (CAS 82799-32-4) is a chemical compound with molecular formula C36H67ClN2O and molecular weight 578.49 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-dibutyl-[3-(octadecanoylamino)propyl]azanium chloride
Also Known As: EINECS 280-032-1, Benzyldibutyl(3-((1-oxooctadecyl)amino)propyl)ammonium chloride, benzyl-dibutyl-[3-(octadecanoylamino)propyl]azanium;chloride, Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride, benzyl-dibutyl-[3-(octadecanoylamino)propyl]azanium chloride
| Molecular Formula | C36H67ClN2O |
|---|---|
| Molecular Weight | 578.49 g/mol |
| LogP | 7.3754 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 28 |
| Exact Mass | 578.4942 |
| Heavy Atoms | 40 |
| Complexity | 658.0218 |
Chemical Identifiers
| CAS Number | 82799-32-4 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](CCCC)(CCCC)CC1=CC=CC=C1.[Cl-] |
Product Overview
Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride (CAS 82799-32-4), with molecular formula C36H67ClN2O and molecular weight 578.49 g/mol. IUPAC: benzyl-dibutyl-[3-(octadecanoylamino)propyl]azanium chloride.
Chemical Property Profile of Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride
Property Insights of Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride
The XLogP value of 7.3754 indicates that Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride?
The CAS number of Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride is 82799-32-4.
What is the molecular formula of Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride?
The molecular formula of Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride is C36H67ClN2O.
What is the molecular weight of Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride?
The molecular weight of Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride is 578.49 g/mol.
Where can I buy Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride?
You can request a quote for Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride?
Yes, KEHONG BIO provides custom synthesis services for Benzenemethanaminium, N,N-dibutyl-N-(3-((1-oxooctadecyl)amino)propyl)-, chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.