Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1)
TL;DR: Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1) (CAS 3532-76-1) is a chemical compound with molecular formula C23H24BrClN2 and molecular weight 442.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(6-bromo-1-ethylbenzo[cd]indol-1-ium-2-yl)-N,N-diethylaniline chloride
Also Known As: 6-Bromo-2-(4-(diethylamino)phenyl)-1-ethylbenz(c,d)indolium, chloride, 6-Bromo-2-(4-(diethylamino)phenyl)-1-ethylbenz(cd)indolium chloride, Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride, 6-bromo-2-[4-(diethylamino)phenyl]-1-ethylbenzo[cd]indolium chloride, Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1)
| Molecular Formula | C23H24BrClN2 |
|---|---|
| Molecular Weight | 442.08 g/mol |
| LogP | 2.9674 |
| Topological Polar Surface Area | 6.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 442.08115 |
| Heavy Atoms | 27 |
| Complexity | 518.0 |
Chemical Identifiers
| CAS Number | 3532-76-1 |
|---|---|
| SMILES | CC[N+]1=C(C2=CC=CC3=C(C=CC1=C32)Br)C4=CC=C(C=C4)N(CC)CC.[Cl-] |
| InChIKey | YSXWPYRZUULDLM-UHFFFAOYSA-M |
Product Overview
Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1) (CAS 3532-76-1), with molecular formula C23H24BrClN2 and molecular weight 442.08 g/mol. IUPAC: 4-(6-bromo-1-ethylbenzo[cd]indol-1-ium-2-yl)-N,N-diethylaniline chloride.
Chemical Property Profile of Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1)
Property Insights of Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1)
The XLogP value of 2.9674 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1). With a topological polar surface area (TPSA) of 6.3 Ų, Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1) has 0 hydrogen bond donor(s) and 2 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 Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1)?
The CAS number of Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1) is 3532-76-1.
What is the molecular formula of Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1)?
The molecular formula of Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1) is C23H24BrClN2.
What is the molecular weight of Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1)?
The molecular weight of Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1) is 442.08 g/mol.
Where can I buy Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1)?
You can request a quote for Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Benz(cd)indolium, 6-bromo-2-(4-(diethylamino)phenyl)-1-ethyl-, chloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.