RefChem:368293
TL;DR: RefChem:368293 (CAS 3218-37-9) is a chemical compound with molecular formula C29H38F3NO8 and molecular weight 585.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-4-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]pentan-1-amine;2-hydroxypropane-1,2,3-tricarboxylic acid
Also Known As: N,N-Diethyl-4-(alpha-(alpha,alpha,alpha-trifluoro-o-tolyl)benzyloxy)pentylamine citrate, Pentylamine, N,N-diethyl-4-(alpha-(alpha,alpha,alpha-trifluoro-o-tolyl)benzyloxy)-, citrate, 2-Hydroxypropane-1,2,3-tricarboxylic acid--N,N-diethyl-4-{phenyl[2-(trifluoromethyl)phenyl]methoxy}pentan-1-amine (1/1), N,N-diethyl-4-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]pentan-1-amine; 2-hydroxypropane-1,2,3-tricarboxylic acid, RefChem:368293
| Molecular Formula | C29H38F3NO8 |
|---|---|
| Molecular Weight | 585.25 g/mol |
| LogP | 5.0734 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 15 |
| Exact Mass | 585.25494 |
| Heavy Atoms | 41 |
| Complexity | 646.0 |
Chemical Identifiers
| CAS Number | 3218-37-9 |
|---|---|
| SMILES | CCN(CC)CCCC(C)OC(C1=CC=CC=C1)C2=CC=CC=C2C(F)(F)F.C(C(=O)O)C(CC(=O)O)(C(=O)O)O |
| InChIKey | RAAJXWASYMJQFQ-UHFFFAOYSA-N |
Product Overview
RefChem:368293 (CAS 3218-37-9), with molecular formula C29H38F3NO8 and molecular weight 585.25 g/mol. IUPAC: N,N-diethyl-4-[phenyl-[2-(trifluoromethyl)phenyl]methoxy]pentan-1-amine;2-hydroxypropane-1,2,3-tricarboxylic acid.
Chemical Property Profile of RefChem:368293
Property Insights of RefChem:368293
The XLogP value of 5.0734 indicates that RefChem:368293 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.0 Ų indicates high polarity, suggesting RefChem:368293 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:368293 has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:368293?
The CAS number of RefChem:368293 is 3218-37-9.
What is the molecular formula of RefChem:368293?
The molecular formula of RefChem:368293 is C29H38F3NO8.
What is the molecular weight of RefChem:368293?
The molecular weight of RefChem:368293 is 585.25 g/mol.
Where can I buy RefChem:368293?
You can request a quote for RefChem:368293 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:368293?
Yes, KEHONG BIO provides custom synthesis services for RefChem:368293 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.