RefChem:564219
TL;DR: RefChem:564219 (CAS 72208-27-6) is a chemical compound with molecular formula C48H48N10O8S2 and molecular weight 956.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(1,2-bis(2-methylphenyl)guanidine);3-[[2,4-dihydroxy-5-[(3-sulfophenyl)diazenyl]phenyl]diazenyl]benzenesulfonic acid
Also Known As: Benzenesulfonic acid, 3,3'-((4,6-dihydroxy-1,3-phenylene)bis(2,1-diazenediyl))bis-, compd. with N,N'-bis(2-methylphenyl)guanidine (1:2), Benzenesulfonic acid, 3,3'-((4,6-dihydroxy-1,3-phenylene)bis(azo))bis-, compd. with N,N'-bis(2-methylphenyl)guanidine (1:2), Benzenesulfonic acid, 3,3'-[(4,6-dihydroxy-1,3-phenylene)bis(azo)]bis-, compd. with N,N'-bis(2-methylphenyl)guanidine (1:2), 1,2-bis(2-methylphenyl)guanidine; 3-[(2E)-2-[4-hydroxy-6-oxo-3-[(3-sulfophenyl)diazenyl]cyclohexa-2,4-dien-1-ylidene]hydrazinyl]benzenesulfonic acid, 3,3'-((4,6-Dihydroxy-m-phenylene)diazo)dibenzenesulphonic acid, compound with N,N'-di(o-tolyl)guanidine (1:2)
| Molecular Formula | C48H48N10O8S2 |
|---|---|
| Molecular Weight | 956.31 g/mol |
| LogP | 11.14548 |
| Topological Polar Surface Area | 316.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 12 |
| Exact Mass | 956.3098 |
| Heavy Atoms | 68 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 72208-27-6 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.CC1=CC=CC=C1NC(=NC2=CC=CC=C2C)N.C1=CC(=CC(=C1)S(=O)(=O)O)N=NC2=CC(=C(C=C2O)O)N=NC3=CC(=CC=C3)S(=O)(=O)O |
| InChIKey | YDLJXOVUUVKLJB-UHFFFAOYSA-N |
Product Overview
RefChem:564219 (CAS 72208-27-6), with molecular formula C48H48N10O8S2 and molecular weight 956.31 g/mol. IUPAC: bis(1,2-bis(2-methylphenyl)guanidine);3-[[2,4-dihydroxy-5-[(3-sulfophenyl)diazenyl]phenyl]diazenyl]benzenesulfonic acid.
Chemical Property Profile of RefChem:564219
Property Insights of RefChem:564219
The XLogP value of 11.14548 indicates that RefChem:564219 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 316.0 Ų indicates high polarity, suggesting RefChem:564219 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:564219 has 8 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:564219?
The CAS number of RefChem:564219 is 72208-27-6.
What is the molecular formula of RefChem:564219?
The molecular formula of RefChem:564219 is C48H48N10O8S2.
What is the molecular weight of RefChem:564219?
The molecular weight of RefChem:564219 is 956.31 g/mol.
Where can I buy RefChem:564219?
You can request a quote for RefChem:564219 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:564219?
Yes, KEHONG BIO provides custom synthesis services for RefChem:564219 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.