Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro-
TL;DR: Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro- (CAS 3810-59-1) is a chemical compound with molecular formula C16H23NO2 and molecular weight 261.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azocane
Also Known As: 1-(1,4-Benzodioxan-2-ylmethyl)octahydroazocine, 5-20-04-00166 (Beilstein Handbook Reference), Heptamethylenimine, 1-(1,4-benzodioxin-2-ylmethyl)-, 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azocane, AZOCINE, OCTAHYDRO-1-(1,4-BENZODIOXAN-2-YLMETHYL)-
| Molecular Formula | C16H23NO2 |
|---|---|
| Molecular Weight | 261.17 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 261.17288 |
| Heavy Atoms | 19 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 3810-59-1 |
|---|---|
| SMILES | C1CCCN(CCC1)CC2COC3=CC=CC=C3O2 |
| InChIKey | YXJCIUZUGUSPRL-UHFFFAOYSA-N |
Product Overview
Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro- (CAS 3810-59-1), with molecular formula C16H23NO2 and molecular weight 261.17 g/mol. IUPAC: 1-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)azocane.
Chemical Property Profile of Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro-
Property Insights of Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro-
The XLogP value of 3.5 indicates that Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.7 Ų, Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro- has 0 hydrogen bond donor(s) and 3 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 Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro-?
The CAS number of Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro- is 3810-59-1.
What is the molecular formula of Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro-?
The molecular formula of Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro- is C16H23NO2.
What is the molecular weight of Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro-?
The molecular weight of Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro- is 261.17 g/mol.
Where can I buy Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro-?
You can request a quote for Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro-?
Yes, KEHONG BIO provides custom synthesis services for Azocine, 1-((2,3-dihydro-1,4-benzodioxin-2-yl)methyl)octahydro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.