RefChem:378821
TL;DR: RefChem:378821 (CAS 18355-53-8) is a chemical compound with molecular formula C48H44N4O8S2+2 and molecular weight 868.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(4-methylbenzenesulfonic acid);N-(1-methylquinolin-1-ium-7-yl)-4-[4-[(1-methylquinolin-1-ium-7-yl)carbamoyl]phenyl]benzamide
Also Known As: Quinolinium, 7,7'-(p,p'-biphenylylenebis(carbonylimino))bis(1-methyl-, ditosylate, 7,7'-(p,p'-Biphenylylenebis(carbonylimino))bis(1-methylquinolinium) ditosylate, 7,7/'-(p,p/'-Biphenylylenebis(carbonylimino))bis(1-methylquinolinium) ditosylate, 4-methylbenzenesulfonic acid;N-(1-methylquinolin-1-ium-7-yl)-4-[4-[(1-methylquinolin-1-ium-7-yl)carbamoyl]phenyl]benzamide, Quinolinium,6,6'-(p,p'-biphenylylenebis(carbonylimino))bis(1-methyl-,ditosylate
| Molecular Formula | C48H44N4O8S2+2 |
|---|---|
| Molecular Weight | 868.26 g/mol |
| LogP | 8.29704 |
| Topological Polar Surface Area | 191.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 868.2601 |
| Heavy Atoms | 62 |
| Complexity | 1000.0 |
Chemical Identifiers
| CAS Number | 18355-53-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O.CC1=CC=C(C=C1)S(=O)(=O)O.C[N+]1=CC=CC2=C1C=C(C=C2)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)NC5=CC6=C(C=CC=[N+]6C)C=C5 |
| InChIKey | GTCOVEZJAPGWQC-UHFFFAOYSA-P |
Product Overview
RefChem:378821 (CAS 18355-53-8), with molecular formula C48H44N4O8S2+2 and molecular weight 868.26 g/mol. IUPAC: bis(4-methylbenzenesulfonic acid);N-(1-methylquinolin-1-ium-7-yl)-4-[4-[(1-methylquinolin-1-ium-7-yl)carbamoyl]phenyl]benzamide.
Chemical Property Profile of RefChem:378821
Property Insights of RefChem:378821
The XLogP value of 8.29704 indicates that RefChem:378821 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 191.0 Ų indicates high polarity, suggesting RefChem:378821 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:378821 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 RefChem:378821?
The CAS number of RefChem:378821 is 18355-53-8.
What is the molecular formula of RefChem:378821?
The molecular formula of RefChem:378821 is C48H44N4O8S2+2.
What is the molecular weight of RefChem:378821?
The molecular weight of RefChem:378821 is 868.26 g/mol.
Where can I buy RefChem:378821?
You can request a quote for RefChem:378821 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:378821?
Yes, KEHONG BIO provides custom synthesis services for RefChem:378821 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.