RefChem:339156
TL;DR: RefChem:339156 (CAS 5938-85-2) is a chemical compound with molecular formula C29H20N6Na2O8S2 and molecular weight 690.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;7-[(4-aminobenzoyl)amino]-4-hydroxy-3-[[4-[(4-sulfonatophenyl)diazenyl]phenyl]diazenyl]naphthalene-2-sulfonate
Also Known As: Disodium 7-((4-aminobenzoyl)amino)-4-hydroxy-3-((4-((4-sulphonatophenyl)azo)phenyl)azo)naphthalene-2-sulphonate, disodium7-[ amino]-4-hydroxy-3-[[4-[ azo]phenyl]azo]naphthalene-2-sulphonate, 2-Naphthalenesulfonic acid, 7-((4-aminobenzoyl)amino)-4-hydroxy-3-((4-((4-sulfophenyl)azo)phenyl)azo)-, disodium salt, 2-Naphthalenesulfonic acid, 7-((4-aminobenzoyl)amino)-4-hydroxy-3-(2-(4-(2-(4-sulfophenyl)diazenyl)phenyl)diazenyl)-, sodium salt (1:2), 2-Naphthalenesulfonic acid,7-((4-aminobenzoyl)amino)-4-hydroxy-3-(2-(4-(2-(4-sulfophenyl)diazenyl)phenyl)diazenyl)-,sodium salt (1:2)
| Molecular Formula | C29H20N6Na2O8S2 |
|---|---|
| Molecular Weight | 690.06 g/mol |
| LogP | 0.0269 |
| Topological Polar Surface Area | 256.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 690.0579 |
| Heavy Atoms | 47 |
| Complexity | 1250.0 |
Chemical Identifiers
| CAS Number | 5938-85-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NC2=CC3=CC(=C(C(=C3C=C2)O)N=NC4=CC=C(C=C4)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+] |
| InChIKey | QKXHVVHWIWQWCB-UHFFFAOYSA-L |
Product Overview
RefChem:339156 (CAS 5938-85-2), with molecular formula C29H20N6Na2O8S2 and molecular weight 690.06 g/mol. IUPAC: disodium;7-[(4-aminobenzoyl)amino]-4-hydroxy-3-[[4-[(4-sulfonatophenyl)diazenyl]phenyl]diazenyl]naphthalene-2-sulfonate.
Chemical Property Profile of RefChem:339156
Property Insights of RefChem:339156
The XLogP value of 0.0269 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:339156. The TPSA of 256.0 Ų indicates high polarity, suggesting RefChem:339156 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:339156 has 3 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:339156?
The CAS number of RefChem:339156 is 5938-85-2.
What is the molecular formula of RefChem:339156?
The molecular formula of RefChem:339156 is C29H20N6Na2O8S2.
What is the molecular weight of RefChem:339156?
The molecular weight of RefChem:339156 is 690.06 g/mol.
Where can I buy RefChem:339156?
You can request a quote for RefChem:339156 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:339156?
Yes, KEHONG BIO provides custom synthesis services for RefChem:339156 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.