1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)-
TL;DR: 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)- (CAS 65180-62-3) is a chemical compound with molecular formula C31H30Cl3N7O17S6 and molecular weight 1068.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-[bis[2-(2-chloroethylsulfonyl)ethyl]amino]-6-chloro-1,3,5-triazin-2-yl]amino]-3-[(1,5-disulfonaphthalen-2-yl)diazenyl]-4-hydroxynaphthalene-2,7-disulfonic acid
Also Known As: 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)-, 1,5-Naphthalenedisulfonic acid, 2-((8-((4-(bis(2-((2-chloroethyl)sulfonyl)ethyl)amino)-6-chloro-1,3,5-triazin-2-yl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-, 1,5-Naphthalenedisulfonic acid, 2-(2-(8-((4-(bis(2-((2-chloroethyl)sulfonyl)ethyl)amino)-6-chloro-1,3,5-triazin-2-yl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)diazenyl)-, 1,5-Naphthalenedisulfonic acid, 2-[[8-[[4-[bis[2-[(2-chloroethyl)sulfonyl]ethyl]amino]-6-chloro-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]azo]-, (3Z)-5-[[4-[bis[2-(2-chloroethylsulfonyl)ethyl]amino]-6-chloro-1,3,5-triazin-2-yl]amino]-3-[(1,5-disulfonaphthalen-2-yl)hydrazinylidene]-4-oxonaphthalene-2,7-disulfonic acid
| Molecular Formula | C31H30Cl3N7O17S6 |
|---|---|
| Molecular Weight | 1068.91 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 435.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 24 |
| Rotatable Bonds | 19 |
| Exact Mass | 1068.9088 |
| Heavy Atoms | 64 |
| Complexity | 2280.0 |
Chemical Identifiers
| CAS Number | 65180-62-3 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=C2S(=O)(=O)O)N=NC3=C(C4=C(C=C(C=C4C=C3S(=O)(=O)O)S(=O)(=O)O)NC5=NC(=NC(=N5)Cl)N(CCS(=O)(=O)CCCl)CCS(=O)(=O)CCCl)O)C(=C1)S(=O)(=O)O |
| InChIKey | IVOQXPVUAZBANB-UHFFFAOYSA-N |
Product Overview
1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)- (CAS 65180-62-3), with molecular formula C31H30Cl3N7O17S6 and molecular weight 1068.91 g/mol. IUPAC: 5-[[4-[bis[2-(2-chloroethylsulfonyl)ethyl]amino]-6-chloro-1,3,5-triazin-2-yl]amino]-3-[(1,5-disulfonaphthalen-2-yl)diazenyl]-4-hydroxynaphthalene-2,7-disulfonic acid.
Chemical Property Profile of 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)-
Property Insights of 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)-. The TPSA of 435.0 Ų indicates high polarity, suggesting 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)- has 6 hydrogen bond donor(s) and 24 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)-?
The CAS number of 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)- is 65180-62-3.
What is the molecular formula of 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)-?
The molecular formula of 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)- is C31H30Cl3N7O17S6.
What is the molecular weight of 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)-?
The molecular weight of 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)- is 1068.91 g/mol.
Where can I buy 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)-?
You can request a quote for 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)-?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Naphthalenedisulfonic acid, 2-((8-((2-chloro-6-(N,N-di(((2-chloroethyl)sulfonyl)ethyl)amino)-1,3,5-triaz-4-yl)amino)-1-hydroxy-3,6-disulfonaphth-2-yl)azo)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.