![3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid structure](/static/products/4948/494826-92-5.webp)
3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid
TL;DR: 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid (CAS 494826-92-5) is a chemical compound with molecular formula C18H21NO4S and molecular weight 347.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid
Also Known As: CBKinase1_007102, CBKinase1_019502, AQ-390/42425851, BRD-A61305790-001-01-8, 3-phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid
| Molecular Formula | C18H21NO4S |
|---|---|
| Molecular Weight | 347.12 g/mol |
| LogP | 3.10616 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 347.11914 |
| Heavy Atoms | 24 |
| Complexity | 844.8225 |
Chemical Identifiers
| CAS Number | 494826-92-5 |
|---|---|
| SMILES | CC1=CC(=C(C=C1C)S(=O)(=O)NC(CC(=O)O)C2=CC=CC=C2)C |
Product Overview
3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid (CAS 494826-92-5), with molecular formula C18H21NO4S and molecular weight 347.12 g/mol. IUPAC: 3-phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid.
Chemical Property Profile of 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid
Property Insights of 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid
The XLogP value of 3.10616 indicates that 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid. Following Lipinski's Rule of Five, 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid has 2 hydrogen bond donor(s) and 3 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 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid?
The CAS number of 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid is 494826-92-5.
What is the molecular formula of 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid?
The molecular formula of 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid is C18H21NO4S.
What is the molecular weight of 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid?
The molecular weight of 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid is 347.12 g/mol.
Where can I buy 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid?
You can request a quote for 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyl-3-[(2,4,5-trimethylphenyl)sulfonylamino]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.