Dan 2816
TL;DR: Dan 2816 (CAS 65236-27-3) is a chemical compound with molecular formula C54H64N2O6 and molecular weight 836.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-methyl-N-[2-[(4-methylphenyl)-phenylmethoxy]ethyl]-1-phenylpropan-2-amine);oxalic acid
Also Known As: DAN 2816, C26H31NO.1/2C2H2O4, C26-H31-N-O.1/2C2-H2-O4, alpha,alpha-Dimethyl-N-(2-((4-methylphenyl)phenylmethoxy)ethyl)phenethylamine oxalate (2:1), Phenethylamine, alpha,alpha-dimethyl-N-(2-((4-methylphenyl)phenylmethoxy)ethyl)-, ethanedioate (2:1)
| Molecular Formula | C54H64N2O6 |
|---|---|
| Molecular Weight | 836.48 g/mol |
| LogP | 10.57944 |
| Topological Polar Surface Area | 117.12 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 18 |
| Exact Mass | 836.47644 |
| Heavy Atoms | 62 |
| Complexity | 2001.9299 |
Chemical Identifiers
| CAS Number | 65236-27-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCCNC(C)(C)CC3=CC=CC=C3.CC1=CC=C(C=C1)C(C2=CC=CC=C2)OCCNC(C)(C)CC3=CC=CC=C3.C(=O)(C(=O)O)O |
Product Overview
Dan 2816 (CAS 65236-27-3), with molecular formula C54H64N2O6 and molecular weight 836.48 g/mol. IUPAC: bis(2-methyl-N-[2-[(4-methylphenyl)-phenylmethoxy]ethyl]-1-phenylpropan-2-amine);oxalic acid.
Chemical Property Profile of Dan 2816
Property Insights of Dan 2816
The XLogP value of 10.57944 indicates that Dan 2816 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.12 Ų falls within the moderate polarity range, balancing permeability and solubility for Dan 2816. Following Lipinski's Rule of Five, Dan 2816 has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dan 2816?
The CAS number of Dan 2816 is 65236-27-3.
What is the molecular formula of Dan 2816?
The molecular formula of Dan 2816 is C54H64N2O6.
What is the molecular weight of Dan 2816?
The molecular weight of Dan 2816 is 836.48 g/mol.
Where can I buy Dan 2816?
You can request a quote for Dan 2816 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dan 2816?
Yes, KEHONG BIO provides custom synthesis services for Dan 2816 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.