![2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate structure](/static/products/742/74276-27-0.png)
2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate
TL;DR: 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate (CAS 74276-27-0) is a chemical compound with molecular formula C33H33ClN2O4 and molecular weight 556.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,3-trimethyl-2-[3-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]benzo[e]indole perchlorate
Also Known As: 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate
| Molecular Formula | C33H33ClN2O4 |
|---|---|
| Molecular Weight | 556.21 g/mol |
| LogP | 3.1107 |
| Topological Polar Surface Area | 98.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 556.2129 |
| Heavy Atoms | 40 |
| Complexity | 1722.0736 |
Chemical Identifiers
| CAS Number | 74276-27-0 |
|---|---|
| SMILES | CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)C)C=CC=C4C(C5=C(N4C)C=CC6=CC=CC=C65)(C)C)C.[O-]Cl(=O)(=O)=O |
Product Overview
2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate (CAS 74276-27-0), with molecular formula C33H33ClN2O4 and molecular weight 556.21 g/mol. IUPAC: 1,1,3-trimethyl-2-[3-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]benzo[e]indole perchlorate.
Chemical Property Profile of 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate
Property Insights of 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate
The XLogP value of 3.1107 indicates that 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate. Following Lipinski's Rule of Five, 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate?
The CAS number of 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate is 74276-27-0.
What is the molecular formula of 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate?
The molecular formula of 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate is C33H33ClN2O4.
What is the molecular weight of 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate?
The molecular weight of 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate is 556.21 g/mol.
Where can I buy 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate?
You can request a quote for 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(1,3-dihydro-1,1,3-trimethyl-2h-benz[e]indol-2-ylidene)-1-propen-1-yl]-1,1,3-trimethyl-1h-benz[e]indolium perchlorate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.