![(3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule structure](/static/products/2774/27747-18-8.webp)
(3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule
TL;DR: (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule (CAS 27747-18-8) is a chemical compound with molecular formula C21H24ClNO and molecular weight 341.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-3-(7-methyl-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)propan-1-amine oxide;hydrochloride
Also Known As: (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule
| Molecular Formula | C21H24ClNO |
|---|---|
| Molecular Weight | 341.15 g/mol |
| LogP | 5.29662 |
| Topological Polar Surface Area | 18.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 341.15463 |
| Heavy Atoms | 24 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 27747-18-8 |
|---|---|
| SMILES | CC1=C2C=CC3=CC=CC=C3C(=CCC[N+](C)(C)[O-])C2=CC=C1.Cl |
| InChIKey | MZQZFABHYDJNKO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule (CAS 27747-18-8), with molecular formula C21H24ClNO and molecular weight 341.15 g/mol. IUPAC: N,N-dimethyl-3-(7-methyl-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenylidene)propan-1-amine oxide;hydrochloride.
Chemical Property Profile of (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule
Property Insights of (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule
The XLogP value of 5.29662 indicates that (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.1 Ų, (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule?
The CAS number of (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule is 27747-18-8.
What is the molecular formula of (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule?
The molecular formula of (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule is C21H24ClNO.
What is the molecular weight of (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule?
The molecular weight of (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule is 341.15 g/mol.
Where can I buy (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule?
You can request a quote for (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule?
Yes, KEHONG BIO provides custom synthesis services for (3e)-n,n-dimethyl-3-(4-methyldibenzo[1,2-a:1',2'-e][7]annule and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.