RefChem:76505
TL;DR: RefChem:76505 (CAS 68227-40-7) is a chemical compound with molecular formula C22H15N4NaO5S and molecular weight 470.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 8-anilino-5-[(3-nitrophenyl)diazenyl]naphthalene-1-sulfonate
Also Known As: Ucon LB-135, sodium5-[ azo]-8- naphthalenesulphonate, 1-Naphthalenesulfonic acid, 8-(phenylamino)-5-((3-nitrophenyl)azo)-, sodium salt, 5-((m-Nitrophenyl)azo)-8-phenylamino-1-naphthalenesulfonic acid, sodium salt, sodium 5-[(e)-(3-nitrophenyl)diazenyl]-8-(phenylamino)naphthalene-1-sulfonate
| Molecular Formula | C22H15N4NaO5S |
|---|---|
| Molecular Weight | 470.07 g/mol |
| LogP | 2.82 |
| Topological Polar Surface Area | 148.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 470.06607 |
| Heavy Atoms | 33 |
| Complexity | 761.0 |
Chemical Identifiers
| CAS Number | 68227-40-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=C3C(=C(C=C2)N=NC4=CC(=CC=C4)[N+](=O)[O-])C=CC=C3S(=O)(=O)[O-].[Na+] |
| InChIKey | OYXIMNPMVHQQKE-UHFFFAOYSA-M |
Product Overview
RefChem:76505 (CAS 68227-40-7), with molecular formula C22H15N4NaO5S and molecular weight 470.07 g/mol. IUPAC: sodium 8-anilino-5-[(3-nitrophenyl)diazenyl]naphthalene-1-sulfonate.
Chemical Property Profile of RefChem:76505
Property Insights of RefChem:76505
The XLogP value of 2.82 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:76505. The TPSA of 148.0 Ų indicates high polarity, suggesting RefChem:76505 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:76505 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:76505?
The CAS number of RefChem:76505 is 68227-40-7.
What is the molecular formula of RefChem:76505?
The molecular formula of RefChem:76505 is C22H15N4NaO5S.
What is the molecular weight of RefChem:76505?
The molecular weight of RefChem:76505 is 470.07 g/mol.
Where can I buy RefChem:76505?
You can request a quote for RefChem:76505 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:76505?
Yes, KEHONG BIO provides custom synthesis services for RefChem:76505 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.