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4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid structure
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4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid

TL;DR: 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid (CAS 15590-06-4) is a chemical compound with molecular formula C43H56N4O8S and molecular weight 788.3819 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid

Also Known As: 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid, (CARBOXY-HYDROXYPHENYLAZO-OH-NAPHTHAMIDO)-(ME-OCTADECYLAMINO)BENZENESULFONICACID, 1-HYDROXY-4-(2-HYDROXY-5-CARBOXY)-PHENYLAZO-N-(METHYL-OCTADECYLAMINO-5-SULFO)-2-NAPHTHAMIDE, 4-hydroxy-3-[(2E)-2-[3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]-4-oxonaphthalen-1-ylidene]hydrazinyl]benzoic acid, 4-hydroxy-3-[(2Z)-2-[3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]-4-oxonaphthalen-1-ylidene]hydrazinyl]benzoic acid

CAS Number
15590-06-4
Molecular Formula
C43H56N4O8S
Molecular Weight
788.3819 g/mol
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Technical Specifications

Molecular FormulaC43H56N4O8S
Molecular Weight788.3819 g/mol
XLogP12.9
Topological Polar Surface Area (TPSA)198.0 Ų
Hydrogen Bond Donors5
Hydrogen Bond Acceptors11
Rotatable Bonds24
Exact Mass788.3819 Da
Heavy Atoms56
Complexity1300.0
SMILESCCCCCCCCCCCCCCCCCCN(C)C1=C(C=C(C=C1)S(=O)(=O)O)NC(=O)C2=C(C3=CC=CC=C3C(=C2)N=NC4=C(C=CC(=C4)C(=O)O)O)O
InChIKeyZHSYRKXDOQEMFY-UHFFFAOYSA-N

Chemical Property Profile of 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid

XLogP
12.9
TPSA (Topological Polar Surface Area)
198.0
Hydrogen Bond Donors
5
Hydrogen Bond Acceptors
11
Rotatable Bonds
24
Heavy Atoms
56
Complexity
1300.0
Exact Mass
788.3819
Monoisotopic Mass
788.3819
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid

The XLogP value of 12.9 indicates that 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 198.0 Ų indicates high polarity, suggesting 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid?

The CAS number of 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid is 15590-06-4.

What is the molecular formula of 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid?

The molecular formula of 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid is C43H56N4O8S.

What is the molecular weight of 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid?

The molecular weight of 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid is 788.3819 g/mol.

Where can I buy 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid?

You can request a quote for 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid?

Yes, CoreyChem provides custom synthesis services for 4-Hydroxy-3-[[4-hydroxy-3-[[2-[methyl(octadecyl)amino]-5-sulfophenyl]carbamoyl]naphthalen-1-yl]diazenyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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