Dye NK 1841
TL;DR: Dye NK 1841 (CAS 64285-36-5) is a chemical compound with molecular formula C41H45N2NaO6S2 and molecular weight 748.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 4-[(2Z)-2-[(2E,4E)-5-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]penta-2,4-dienylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate
Also Known As: Dye NK 1841, NK 1841 (Dye), benzoindodicarbocyanine sodium salt, 3,3,3',3'-Tetramethyl-1,1'-bis(4-sulfobutyl), 1H-Benz(e)indolium, 2-(5-(1,3-dihydro-1,1-dimethyl-3-(4-sulfobutyl)-2H-benz(e)indol-2-ylidene)-1,3-pentadienyl)-1,1-dimethyl-3-(4-sulfobutyl)-, hydroxide, inner salt, sodium salt
| Molecular Formula | C41H45N2NaO6S2 |
|---|---|
| Molecular Weight | 748.26 g/mol |
| LogP | 4.8181 |
| Topological Polar Surface Area | 120.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 748.26166 |
| Heavy Atoms | 52 |
| Complexity | 2341.4941 |
Chemical Identifiers
| CAS Number | 64285-36-5 |
|---|---|
| SMILES | CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)CCCCS(=O)(=O)[O-])/C=C/C=C/C=C\4/C(C5=C(N4CCCCS(=O)(=O)[O-])C=CC6=CC=CC=C65)(C)C)C.[Na+] |
Product Overview
Dye NK 1841 (CAS 64285-36-5), with molecular formula C41H45N2NaO6S2 and molecular weight 748.26 g/mol. IUPAC: sodium 4-[(2Z)-2-[(2E,4E)-5-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]penta-2,4-dienylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate.
Chemical Property Profile of Dye NK 1841
Property Insights of Dye NK 1841
The XLogP value of 4.8181 indicates that Dye NK 1841 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.65 Ų falls within the moderate polarity range, balancing permeability and solubility for Dye NK 1841. Following Lipinski's Rule of Five, Dye NK 1841 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dye NK 1841?
The CAS number of Dye NK 1841 is 64285-36-5.
What is the molecular formula of Dye NK 1841?
The molecular formula of Dye NK 1841 is C41H45N2NaO6S2.
What is the molecular weight of Dye NK 1841?
The molecular weight of Dye NK 1841 is 748.26 g/mol.
Where can I buy Dye NK 1841?
You can request a quote for Dye NK 1841 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dye NK 1841?
Yes, KEHONG BIO provides custom synthesis services for Dye NK 1841 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.