Red sensitizer Brk 5714
TL;DR: Red sensitizer Brk 5714 (CAS 23216-67-3) is a chemical compound with molecular formula C39H47N3O6S4 and molecular weight 781.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethylethanamine;3-[2-[2-[[1-(3-sulfopropyl)benzo[e][1,3]benzothiazol-2-ylidene]methyl]but-1-enyl]benzo[e][1,3]benzothiazol-1-ium-1-yl]propane-1-sulfonate
Also Known As: Red sensitizer Brk 5714, N,N-diethylethanamine;3-[2-[2-[[1-(3-sulfopropyl)benzo[e][1,3]benzothiazol-2-ylidene]methyl]but-1-enyl]benzo[e][1,3]benzothiazol-1-ium-1-yl]propane-1-sulfonate, 3,3'-BIS(3-SULFOPROPYL)-4,5:4',5'-DIBENZO-9-ETHYLTHIACARBOCYANINE BETAINE TRIETHYLAMMONIUM SALT, -d]thiazol-2(1h)-ylidene]methyl]-1-butenyl]-,hydroxide,innersalt,compd.wit, Hydrogen 1-(3-sulphonatopropyl)-2-(2-((1-(3-sulphonatopropyl)naphtho(1,2-d)thiazolin-2-ylidene)methyl)but-1-enyl)naphtho(1,2-d)thiazolium, compound with triethylamine
| Molecular Formula | C39H47N3O6S4 |
|---|---|
| Molecular Weight | 781.23 g/mol |
| LogP | 8.3 |
| Topological Polar Surface Area | 192.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 13 |
| Exact Mass | 781.23474 |
| Heavy Atoms | 52 |
| Complexity | 1320.0 |
Chemical Identifiers
| CAS Number | 23216-67-3 |
|---|---|
| SMILES | CCC(=CC1=[N+](C2=C(S1)C=CC3=CC=CC=C32)CCCS(=O)(=O)[O-])C=C4N(C5=C(S4)C=CC6=CC=CC=C65)CCCS(=O)(=O)O.CCN(CC)CC |
| InChIKey | IRGJPQDDBXQCAP-UHFFFAOYSA-N |
Product Overview
Red sensitizer Brk 5714 (CAS 23216-67-3), with molecular formula C39H47N3O6S4 and molecular weight 781.23 g/mol. IUPAC: N,N-diethylethanamine;3-[2-[2-[[1-(3-sulfopropyl)benzo[e][1,3]benzothiazol-2-ylidene]methyl]but-1-enyl]benzo[e][1,3]benzothiazol-1-ium-1-yl]propane-1-sulfonate.
Chemical Property Profile of Red sensitizer Brk 5714
Property Insights of Red sensitizer Brk 5714
The XLogP value of 8.3 indicates that Red sensitizer Brk 5714 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 192.0 Ų indicates high polarity, suggesting Red sensitizer Brk 5714 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Red sensitizer Brk 5714 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Red sensitizer Brk 5714?
The CAS number of Red sensitizer Brk 5714 is 23216-67-3.
What is the molecular formula of Red sensitizer Brk 5714?
The molecular formula of Red sensitizer Brk 5714 is C39H47N3O6S4.
What is the molecular weight of Red sensitizer Brk 5714?
The molecular weight of Red sensitizer Brk 5714 is 781.23 g/mol.
Where can I buy Red sensitizer Brk 5714?
You can request a quote for Red sensitizer Brk 5714 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Red sensitizer Brk 5714?
Yes, KEHONG BIO provides custom synthesis services for Red sensitizer Brk 5714 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.