EINECS 287-124-0
TL;DR: EINECS 287-124-0 (CAS 85409-54-7) is a chemical compound with molecular formula C23H20N4O6S2 and molecular weight 512.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-4-hydroxy-3-[[2-methyl-5-(phenylsulfamoyl)phenyl]diazenyl]naphthalene-2-sulfonic acid
Also Known As: EINECS 287-124-0, EINECS 287-118-8, 6-Amino-3-((5-anilinosulphonyl-2-methylphenyl)azo)-4-hydroxynaphthalene-2-sulphonic acid, 6-Amino-3-[[5-anilinosulfonyl-2-methylphenyl]azo]-4-hydroxynaphthalene-2-sulfonic acid, 6-amino-3-[[5-anilinosulphonyl-2-methylphenyl]azo]-4-hydroxynaphthalene-2-sulphonic acid
| Molecular Formula | C23H20N4O6S2 |
|---|---|
| Molecular Weight | 512.08 g/mol |
| LogP | 4.89892 |
| Topological Polar Surface Area | 171.51 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 512.0824 |
| Heavy Atoms | 35 |
| Complexity | 1686.6821 |
Chemical Identifiers
| CAS Number | 85409-54-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC=C2)N=NC3=C(C=C4C=CC(=CC4=C3O)N)S(=O)(=O)O |
Product Overview
EINECS 287-124-0 (CAS 85409-54-7), with molecular formula C23H20N4O6S2 and molecular weight 512.08 g/mol. IUPAC: 6-amino-4-hydroxy-3-[[2-methyl-5-(phenylsulfamoyl)phenyl]diazenyl]naphthalene-2-sulfonic acid.
Chemical Property Profile of EINECS 287-124-0
Property Insights of EINECS 287-124-0
The XLogP value of 4.89892 indicates that EINECS 287-124-0 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 171.51 Ų indicates high polarity, suggesting EINECS 287-124-0 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 287-124-0 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 EINECS 287-124-0?
The CAS number of EINECS 287-124-0 is 85409-54-7.
What is the molecular formula of EINECS 287-124-0?
The molecular formula of EINECS 287-124-0 is C23H20N4O6S2.
What is the molecular weight of EINECS 287-124-0?
The molecular weight of EINECS 287-124-0 is 512.08 g/mol.
Where can I buy EINECS 287-124-0?
You can request a quote for EINECS 287-124-0 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 287-124-0?
Yes, KEHONG BIO provides custom synthesis services for EINECS 287-124-0 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.