(1-Methylazocan-2-yl)methyl diphenylacetate
TL;DR: (1-Methylazocan-2-yl)methyl diphenylacetate (CAS 63207-03-4) is a chemical compound with molecular formula C23H29NO2 and molecular weight 351.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methylazocan-2-yl)methyl 2,2-diphenylacetate
Also Known As: (1-methylazocan-2-yl)methyl diphenylacetate, KST-1A6829, (1-methylazocan-2-yl)methyl 2,2-diphenylacetate, N-(4-DIETHYLAMINOPHENYL)DODECANAMIDE, Aceticacid, diphenyl-,(octahydro-1-methyl-2-azocinyl)methyl ester (8CI)
| Molecular Formula | C23H29NO2 |
|---|---|
| Molecular Weight | 351.22 g/mol |
| LogP | 5.3 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 351.21982 |
| Heavy Atoms | 26 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 63207-03-4 |
|---|---|
| SMILES | CN1CCCCCCC1COC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | JFCAIPHAGUDUPW-UHFFFAOYSA-N |
Product Overview
(1-Methylazocan-2-yl)methyl diphenylacetate (CAS 63207-03-4), with molecular formula C23H29NO2 and molecular weight 351.22 g/mol. IUPAC: (1-methylazocan-2-yl)methyl 2,2-diphenylacetate.
Chemical Property Profile of (1-Methylazocan-2-yl)methyl diphenylacetate
Property Insights of (1-Methylazocan-2-yl)methyl diphenylacetate
The XLogP value of 5.3 indicates that (1-Methylazocan-2-yl)methyl diphenylacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, (1-Methylazocan-2-yl)methyl diphenylacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Methylazocan-2-yl)methyl diphenylacetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (1-Methylazocan-2-yl)methyl diphenylacetate?
The CAS number of (1-Methylazocan-2-yl)methyl diphenylacetate is 63207-03-4.
What is the molecular formula of (1-Methylazocan-2-yl)methyl diphenylacetate?
The molecular formula of (1-Methylazocan-2-yl)methyl diphenylacetate is C23H29NO2.
What is the molecular weight of (1-Methylazocan-2-yl)methyl diphenylacetate?
The molecular weight of (1-Methylazocan-2-yl)methyl diphenylacetate is 351.22 g/mol.
Where can I buy (1-Methylazocan-2-yl)methyl diphenylacetate?
You can request a quote for (1-Methylazocan-2-yl)methyl diphenylacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Methylazocan-2-yl)methyl diphenylacetate?
Yes, KEHONG BIO provides custom synthesis services for (1-Methylazocan-2-yl)methyl diphenylacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.