5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate
TL;DR: 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate (CAS 84142-03-0) is a chemical compound with molecular formula C22H23ClN2O4 and molecular weight 414.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-but-2-enedioic acid;2-(3-chloro-11-methylbenzo[b][1]benzazepin-5-yl)-N-methylethanamine
Also Known As: 8-Chloro-10-(2-(methylamino)ethyl)-5-methyl-5H-dibenz(b,f)azepine fumarate, 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate, (E)-but-2-enedioic acid; 2-(3-chloro-11-methylbenzo[b][1]benzazepin-5-yl)-N-methylethanamine, RefChem:1073444
| Molecular Formula | C22H23ClN2O4 |
|---|---|
| Molecular Weight | 414.13 g/mol |
| LogP | 4.2832 |
| Topological Polar Surface Area | 89.87 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.13464 |
| Heavy Atoms | 29 |
| Complexity | 937.5785 |
Chemical Identifiers
| CAS Number | 84142-03-0 |
|---|---|
| SMILES | CNCCC1=CC2=CC=CC=C2N(C3=C1C=C(C=C3)Cl)C.C(=C/C(=O)O)\C(=O)O |
Product Overview
5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate (CAS 84142-03-0), with molecular formula C22H23ClN2O4 and molecular weight 414.13 g/mol. IUPAC: (E)-but-2-enedioic acid;2-(3-chloro-11-methylbenzo[b][1]benzazepin-5-yl)-N-methylethanamine.
Chemical Property Profile of 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate
Property Insights of 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate
The XLogP value of 4.2832 indicates that 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate. Following Lipinski's Rule of Five, 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate has 3 hydrogen bond donor(s) and 4 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 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate?
The CAS number of 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate is 84142-03-0.
What is the molecular formula of 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate?
The molecular formula of 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate is C22H23ClN2O4.
What is the molecular weight of 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate?
The molecular weight of 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate is 414.13 g/mol.
Where can I buy 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate?
You can request a quote for 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate?
Yes, KEHONG BIO provides custom synthesis services for 5H-Dibenz(b,f)azepine, 8-chloro-10-(2-(methylamino)ethyl)-5-methyl-, fumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.