5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate)
TL;DR: 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate) (CAS 6453-90-3) is a chemical compound with molecular formula C32H24N2O6S2 and molecular weight 596.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-anilino-5-(4-anilino-5-sulfonaphthalen-1-yl)naphthalene-1-sulfonic acid
Also Known As: Bis-ans, 5,5-Bis(ans), 4,4'-Bans, bis-ANS (potassium salt), Bis(1,8-anilinonaphthalenesulfonate)
| Molecular Formula | C32H24N2O6S2 |
|---|---|
| Molecular Weight | 596.11 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 596.1076 |
| Heavy Atoms | 42 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 6453-90-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=C3C(=C(C=C2)C4=C5C=CC=C(C5=C(C=C4)NC6=CC=CC=C6)S(=O)(=O)O)C=CC=C3S(=O)(=O)O |
| InChIKey | SBYQPEKNMQWJQO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate) (CAS 6453-90-3), with molecular formula C32H24N2O6S2 and molecular weight 596.11 g/mol. IUPAC: 8-anilino-5-(4-anilino-5-sulfonaphthalen-1-yl)naphthalene-1-sulfonic acid.
Chemical Property Profile of 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate)
Property Insights of 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate)
The XLogP value of 6.6 indicates that 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 150.0 Ų indicates high polarity, suggesting 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate) has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate)?
The CAS number of 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate) is 6453-90-3.
What is the molecular formula of 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate)?
The molecular formula of 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate) is C32H24N2O6S2.
What is the molecular weight of 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate)?
The molecular weight of 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate) is 596.11 g/mol.
Where can I buy 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate)?
You can request a quote for 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate)?
Yes, KEHONG BIO provides custom synthesis services for 5,5'-Bis(8-(phenylamino)-1-naphthalenesulfonate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.