RefChem:564285
TL;DR: RefChem:564285 (CAS 27452-68-2) is a chemical compound with molecular formula C28H26N6O3S and molecular weight 526.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-[[4-[2-cyanoethyl(ethyl)amino]-2-methylphenyl]diazenyl]naphthalen-1-yl]diazenyl]benzenesulfonic acid
Also Known As: beta-D-Glucopyranoside, pentachlorophenyl, Benzenesulfonic acid, 3-(2-(4-(2-(4-((2-cyanoethyl)ethylamino)-2-methylphenyl)diazenyl)-1-naphthalenyl)diazenyl)-, Benzenesulfonic acid, 3-[[4-[[4-[(2-cyanoethyl)ethylamino]-2-methylphenyl]azo]-1-naphthalenyl]azo]-, M-[[4-[[4-[(2-CYANOETHYL)ETHYLAMINO]-O-TOLYL]AZO]-1-NAPHTHYL]AZO]BENZENESULPHONIC ACID, 3-[(e)-{4-[(e)-{4-[(2-cyanoethyl)(ethyl)amino]-2-methylphenyl}diazenyl]naphthalen-1-yl}diazenyl]benzenesulfonic acid
| Molecular Formula | C28H26N6O3S |
|---|---|
| Molecular Weight | 526.18 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 526.1787 |
| Heavy Atoms | 38 |
| Complexity | 973.0 |
Chemical Identifiers
| CAS Number | 27452-68-2 |
|---|---|
| SMILES | CCN(CCC#N)C1=CC(=C(C=C1)N=NC2=CC=C(C3=CC=CC=C32)N=NC4=CC(=CC=C4)S(=O)(=O)O)C |
| InChIKey | UFXBCNONMFYXGQ-UHFFFAOYSA-N |
Product Overview
RefChem:564285 (CAS 27452-68-2), with molecular formula C28H26N6O3S and molecular weight 526.18 g/mol. IUPAC: 3-[[4-[[4-[2-cyanoethyl(ethyl)amino]-2-methylphenyl]diazenyl]naphthalen-1-yl]diazenyl]benzenesulfonic acid.
Chemical Property Profile of RefChem:564285
Property Insights of RefChem:564285
The XLogP value of 6.0 indicates that RefChem:564285 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:564285. Following Lipinski's Rule of Five, RefChem:564285 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:564285?
The CAS number of RefChem:564285 is 27452-68-2.
What is the molecular formula of RefChem:564285?
The molecular formula of RefChem:564285 is C28H26N6O3S.
What is the molecular weight of RefChem:564285?
The molecular weight of RefChem:564285 is 526.18 g/mol.
Where can I buy RefChem:564285?
You can request a quote for RefChem:564285 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:564285?
Yes, KEHONG BIO provides custom synthesis services for RefChem:564285 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.