RefChem:434942
TL;DR: RefChem:434942 (CAS 68901-25-7) is a chemical compound with molecular formula C40H22N4O8S3 and molecular weight 782.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-diazonio-5-[2-[1-(6-diazonio-5-oxidonaphthalen-1-yl)sulfonyloxynaphthalen-2-yl]sulfanylnaphthalen-1-yl]oxysulfonylnaphthalen-1-olate
Also Known As: 1-Naphthalenesulfonic acid, 6-diazo-5,6-dihydro-5-oxo-, thiodi-1,2-naphthalenediyl ester, 2,2'-Dihydroxy-1,1'-dinaphthylsulfide, bis(2-diazo-1-naphthol-5-sulfonate), 1-Naphthalenesulfonic acid, 6-diazo-5,6-dihydro-5-oxo-, 1,1'-(thiodi-1,2-naphthalenediyl) ester, Thiodinaphthalene-1,2-diyl tetrakis(6-diazo-5,6-dihydro-5-oxonaphthalene-1-sulphonate), Sulfanediyldi(naphthalene-2,1-diyl) bis(6-diazo-5-oxo-5,6-dihydronaphthalene-1-sulfonate)
| Molecular Formula | C40H22N4O8S3 |
|---|---|
| Molecular Weight | 782.06 g/mol |
| LogP | 13.1 |
| Topological Polar Surface Area | 231.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 782.06 |
| Heavy Atoms | 55 |
| Complexity | 1570.0 |
Chemical Identifiers
| CAS Number | 68901-25-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=C2OS(=O)(=O)C3=CC=CC4=C3C=CC(=C4[O-])[N+]#N)SC5=C(C6=CC=CC=C6C=C5)OS(=O)(=O)C7=CC=CC8=C7C=CC(=C8[O-])[N+]#N |
| InChIKey | DARRPGLRJQJARX-UHFFFAOYSA-N |
Product Overview
RefChem:434942 (CAS 68901-25-7), with molecular formula C40H22N4O8S3 and molecular weight 782.06 g/mol. IUPAC: 2-diazonio-5-[2-[1-(6-diazonio-5-oxidonaphthalen-1-yl)sulfonyloxynaphthalen-2-yl]sulfanylnaphthalen-1-yl]oxysulfonylnaphthalen-1-olate.
Chemical Property Profile of RefChem:434942
Property Insights of RefChem:434942
The XLogP value of 13.1 indicates that RefChem:434942 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 231.0 Ų indicates high polarity, suggesting RefChem:434942 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:434942 has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:434942?
The CAS number of RefChem:434942 is 68901-25-7.
What is the molecular formula of RefChem:434942?
The molecular formula of RefChem:434942 is C40H22N4O8S3.
What is the molecular weight of RefChem:434942?
The molecular weight of RefChem:434942 is 782.06 g/mol.
Where can I buy RefChem:434942?
You can request a quote for RefChem:434942 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:434942?
Yes, KEHONG BIO provides custom synthesis services for RefChem:434942 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.