Dimerasulfa
TL;DR: Dimerasulfa (CAS 76391-88-3) is a chemical compound with molecular formula C14H18N4O5S2 and molecular weight 386.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[(4-aminophenyl)sulfonylamino]-4,6-dimethylpyrimidin-5-yl]ethanesulfonic acid
Also Known As: Dimerasulfa, 2-Sulfanilamido-4,6-dimethylpyrimidineethanesulfonic acid, 2-[2-[(4-aminophenyl)sulfonylamino]-4,6-dimethylpyrimidin-5-yl]ethanesulfonic acid, 5-Pyrimidineethanesulfonic acid, 2-(((4-aminophenyl)sulfonyl)amino)-4,6-dimethyl-, 2-(2-{[(4-aminophenyl)sulfonyl]amino}-4,6-dimethylpyrimidin-5-yl)ethanesulfonic acid
| Molecular Formula | C14H18N4O5S2 |
|---|---|
| Molecular Weight | 386.07 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 169.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 386.07187 |
| Heavy Atoms | 25 |
| Complexity | 623.0 |
Chemical Identifiers
| CAS Number | 76391-88-3 |
|---|---|
| SMILES | CC1=C(C(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)C)CCS(=O)(=O)O |
| InChIKey | MOGPSKQQAYUJOK-UHFFFAOYSA-N |
Product Overview
Dimerasulfa (CAS 76391-88-3), with molecular formula C14H18N4O5S2 and molecular weight 386.07 g/mol. IUPAC: 2-[2-[(4-aminophenyl)sulfonylamino]-4,6-dimethylpyrimidin-5-yl]ethanesulfonic acid.
Chemical Property Profile of Dimerasulfa
Property Insights of Dimerasulfa
The XLogP value of -0.6 indicates that Dimerasulfa is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 169.0 Ų indicates high polarity, suggesting Dimerasulfa may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dimerasulfa has 3 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dimerasulfa?
The CAS number of Dimerasulfa is 76391-88-3.
What is the molecular formula of Dimerasulfa?
The molecular formula of Dimerasulfa is C14H18N4O5S2.
What is the molecular weight of Dimerasulfa?
The molecular weight of Dimerasulfa is 386.07 g/mol.
Where can I buy Dimerasulfa?
You can request a quote for Dimerasulfa directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimerasulfa?
Yes, KEHONG BIO provides custom synthesis services for Dimerasulfa and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.