RefChem:284474
TL;DR: RefChem:284474 (CAS 47893-59-4) is a chemical compound with molecular formula C35H24N6O13S2 and molecular weight 800.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[6-[[6-[(4-carboxyphenyl)diazenyl]-5-hydroxy-7-sulfonaphthalen-2-yl]carbamoylamino]-1-hydroxy-3-sulfonaphthalen-2-yl]diazenyl]benzoic acid
Also Known As: 4,4'-[carbonylbis[imino azo]]dibenzoicacid, (3R,5S)-5-(hydroxymethyl)pyrrolidin-3-ol, hydrochloride, 4,4'-(Carbonylbis(imino(1-hydroxy-3-sulphonaphthalene-6,2-diyl)azo))dibenzoic acid, 4,4 -[(Carbonylbisimino)bis(1-hydroxy-3-sulfo-6,2-naphthalenediylazo)]bisbenzoic acid, 4,4 -[(Carbonyldiimino)bis[(1-hydroxy-3-sulfo-6,2-naphthalenediyl)azo]]bisbenzoic acid
| Molecular Formula | C35H24N6O13S2 |
|---|---|
| Molecular Weight | 800.08 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 331.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 10 |
| Exact Mass | 800.0843 |
| Heavy Atoms | 56 |
| Complexity | 1580.0 |
Chemical Identifiers
| CAS Number | 47893-59-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)O)N=NC2=C(C=C3C=C(C=CC3=C2O)NC(=O)NC4=CC5=CC(=C(C(=C5C=C4)O)N=NC6=CC=C(C=C6)C(=O)O)S(=O)(=O)O)S(=O)(=O)O |
| InChIKey | WMIJIYVKKKOTGP-UHFFFAOYSA-N |
Product Overview
RefChem:284474 (CAS 47893-59-4), with molecular formula C35H24N6O13S2 and molecular weight 800.08 g/mol. IUPAC: 4-[[6-[[6-[(4-carboxyphenyl)diazenyl]-5-hydroxy-7-sulfonaphthalen-2-yl]carbamoylamino]-1-hydroxy-3-sulfonaphthalen-2-yl]diazenyl]benzoic acid.
Chemical Property Profile of RefChem:284474
Property Insights of RefChem:284474
The XLogP value of 4.4 indicates that RefChem:284474 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 331.0 Ų indicates high polarity, suggesting RefChem:284474 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:284474 has 8 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 RefChem:284474?
The CAS number of RefChem:284474 is 47893-59-4.
What is the molecular formula of RefChem:284474?
The molecular formula of RefChem:284474 is C35H24N6O13S2.
What is the molecular weight of RefChem:284474?
The molecular weight of RefChem:284474 is 800.08 g/mol.
Where can I buy RefChem:284474?
You can request a quote for RefChem:284474 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:284474?
Yes, KEHONG BIO provides custom synthesis services for RefChem:284474 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.