Cibacron Red H-D
TL;DR: Cibacron Red H-D (CAS 162127-93-7) is a chemical compound with molecular formula C27H22ClN7O10S3 and molecular weight 735.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[4-chloro-6-(N-ethylanilino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid
Also Known As: Cibacron Red H-D, (3Z)-5-[[4-chloro-6-(N-ethylanilino)-1,3,5-triazin-2-yl]amino]-4-oxo-3-[(2-sulfophenyl)hydrazinylidene]naphthalene-2,7-disulfonic acid, 5-({4-Chloro-6-[ethyl(phenyl)amino]-1,3,5-triazin-2-yl}amino)-4-hydroxy-3-[(2-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid
| Molecular Formula | C27H22ClN7O10S3 |
|---|---|
| Molecular Weight | 735.03 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 287.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 10 |
| Exact Mass | 735.0279 |
| Heavy Atoms | 48 |
| Complexity | 1450.0 |
Chemical Identifiers
| CAS Number | 162127-93-7 |
|---|---|
| SMILES | CCN(C1=CC=CC=C1)C2=NC(=NC(=N2)NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(C(=C4O)N=NC5=CC=CC=C5S(=O)(=O)O)S(=O)(=O)O)Cl |
| InChIKey | KTCBIBVSRIRNAG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cibacron Red H-D (CAS 162127-93-7), with molecular formula C27H22ClN7O10S3 and molecular weight 735.03 g/mol. IUPAC: 5-[[4-chloro-6-(N-ethylanilino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-sulfophenyl)diazenyl]naphthalene-2,7-disulfonic acid.
Chemical Property Profile of Cibacron Red H-D
Property Insights of Cibacron Red H-D
The XLogP value of 4.7 indicates that Cibacron Red H-D is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 287.0 Ų indicates high polarity, suggesting Cibacron Red H-D may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cibacron Red H-D has 5 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Cibacron Red H-D?
The CAS number of Cibacron Red H-D is 162127-93-7.
What is the molecular formula of Cibacron Red H-D?
The molecular formula of Cibacron Red H-D is C27H22ClN7O10S3.
What is the molecular weight of Cibacron Red H-D?
The molecular weight of Cibacron Red H-D is 735.03 g/mol.
Where can I buy Cibacron Red H-D?
You can request a quote for Cibacron Red H-D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cibacron Red H-D?
Yes, KEHONG BIO provides custom synthesis services for Cibacron Red H-D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.