![5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid structure](/static/products/695/6959-99-5.png)
5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid
TL;DR: 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid (CAS 6959-99-5) is a chemical compound with molecular formula C18H14N4O11S and molecular weight 494.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxybenzenesulfonic acid
Also Known As: 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid, 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxybenzenesulfonic acid, 5-(Bis(((2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)carbonyl)amino)methyl)-2-hydroxy-3-methoxybenzenesulfonic acid
| Molecular Formula | C18H14N4O11S |
|---|---|
| Molecular Weight | 494.04 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 225.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 494.03796 |
| Heavy Atoms | 34 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 6959-99-5 |
|---|---|
| SMILES | COC1=C(C(=CC(=C1)C(NC(=O)N2C(=O)C=CC2=O)NC(=O)N3C(=O)C=CC3=O)S(=O)(=O)O)O |
| InChIKey | QLUKTRGZCAKJFI-UHFFFAOYSA-N |
Product Overview
5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid (CAS 6959-99-5), with molecular formula C18H14N4O11S and molecular weight 494.04 g/mol. IUPAC: 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxybenzenesulfonic acid.
Chemical Property Profile of 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid
Property Insights of 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid
The XLogP value of -0.4 indicates that 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 225.0 Ų indicates high polarity, suggesting 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid has 4 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 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid?
The CAS number of 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid is 6959-99-5.
What is the molecular formula of 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid?
The molecular formula of 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid is C18H14N4O11S.
What is the molecular weight of 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid?
The molecular weight of 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid is 494.04 g/mol.
Where can I buy 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid?
You can request a quote for 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[bis[(2,5-dioxopyrrole-1-carbonyl)amino]methyl]-2-hydroxy-3-methoxy-benzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.