N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine
TL;DR: N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine (CAS 364595-92-6) is a chemical compound with molecular formula C14H21NO2 and molecular weight 235.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine
Also Known As: BAS 02141292, BIM-0036921.P001, N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine, (1H,3H,5H-benzo[e]1,3-dioxepan-3-ylmethyl)diethylamine, (5,9-Dihydro-6,8-dioxa-benzocyclohepten-7-ylmethyl)-diethyl-amine
| Molecular Formula | C14H21NO2 |
|---|---|
| Molecular Weight | 235.16 g/mol |
| LogP | 2.4013 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 235.15723 |
| Heavy Atoms | 17 |
| Complexity | 322.83038 |
Chemical Identifiers
| CAS Number | 364595-92-6 |
|---|---|
| SMILES | CCN(CC)CC1OCC2=CC=CC=C2CO1 |
Product Overview
N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine (CAS 364595-92-6), with molecular formula C14H21NO2 and molecular weight 235.16 g/mol. IUPAC: N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine.
Chemical Property Profile of N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine
Property Insights of N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine
The XLogP value of 2.4013 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine. With a topological polar surface area (TPSA) of 21.7 Ų, N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine 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 N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine?
The CAS number of N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine is 364595-92-6.
What is the molecular formula of N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine?
The molecular formula of N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine is C14H21NO2.
What is the molecular weight of N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine?
The molecular weight of N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine is 235.16 g/mol.
Where can I buy N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine?
You can request a quote for N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)-N-ethylethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.