![2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid structure](/static/products/3005/30057-65-9.webp)
2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid
TL;DR: 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid (CAS 30057-65-9) is a chemical compound with molecular formula C20H18N4O7S and molecular weight 458.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid
Also Known As: BAS 00782249, 2-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid, 2-({4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}carbamoyl)benzoic acid, N-[4-(2,6-Dimethoxy-pyrimidin-4-ylsulfamoyl)-phenyl]-phthalamic acid, 2-[(4-{[(2,6-Dimethoxy-4-pyrimidinyl)amino]sulfonyl}anilino)carbonyl]benzoic acid
| Molecular Formula | C20H18N4O7S |
|---|---|
| Molecular Weight | 458.09 g/mol |
| LogP | 2.2451 |
| Topological Polar Surface Area | 156.81 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 458.08963 |
| Heavy Atoms | 32 |
| Complexity | 1238.9448 |
Chemical Identifiers
| CAS Number | 30057-65-9 |
|---|---|
| SMILES | COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)O)OC |
Product Overview
2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid (CAS 30057-65-9), with molecular formula C20H18N4O7S and molecular weight 458.09 g/mol. IUPAC: 2-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid.
Chemical Property Profile of 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid
Property Insights of 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid
The XLogP value of 2.2451 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid. The TPSA of 156.81 Ų indicates high polarity, suggesting 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid has 3 hydrogen bond donor(s) and 8 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 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid?
The CAS number of 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid is 30057-65-9.
What is the molecular formula of 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid?
The molecular formula of 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid is C20H18N4O7S.
What is the molecular weight of 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid?
The molecular weight of 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid is 458.09 g/mol.
Where can I buy 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid?
You can request a quote for 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[[4-[(2,6-Dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.