1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine
TL;DR: 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine (CAS 61450-36-0) is a chemical compound with molecular formula C18H20N2O and molecular weight 280.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-N-methylazetidin-3-amine
Also Known As: 5-22-08-00006 (Beilstein Handbook Reference), 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine, 3-Azetidinamine, 1-(6,11-dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-, (+-)-, 1-(6,11-Dihydrodibenzo[b,e]oxepin-11-yl)-N-methylazetidin-3-amine, 1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-N-methylazetidin-3-amine
| Molecular Formula | C18H20N2O |
|---|---|
| Molecular Weight | 280.16 g/mol |
| LogP | 2.572 |
| Topological Polar Surface Area | 24.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.15756 |
| Heavy Atoms | 21 |
| Complexity | 601.6715 |
Chemical Identifiers
| CAS Number | 61450-36-0 |
|---|---|
| SMILES | CNC1CN(C1)C2C3=CC=CC=C3COC4=CC=CC=C24 |
Product Overview
1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine (CAS 61450-36-0), with molecular formula C18H20N2O and molecular weight 280.16 g/mol. IUPAC: 1-(6,11-dihydrobenzo[c][1]benzoxepin-11-yl)-N-methylazetidin-3-amine.
Chemical Property Profile of 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine
Property Insights of 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine
The XLogP value of 2.572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine. With a topological polar surface area (TPSA) of 24.5 Ų, 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine has 1 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 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine?
The CAS number of 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine is 61450-36-0.
What is the molecular formula of 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine?
The molecular formula of 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine is C18H20N2O.
What is the molecular weight of 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine?
The molecular weight of 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine is 280.16 g/mol.
Where can I buy 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine?
You can request a quote for 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine?
Yes, KEHONG BIO provides custom synthesis services for 1-(6,11-Dihydrodibenz(b,e)oxepin-11-yl)-N-methyl-3-azetidinamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.