2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid
TL;DR: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid (CAS 592473-65-9) is a chemical compound with molecular formula C19H25NO4S and molecular weight 363.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid
Also Known As: CBKinase1_004186, CBKinase1_016586, N-[4-(1-Adamantyl)phenyl]-N-(methylsulfonyl)glycine, 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid, [4-(1-adamantyl)(methylsulfonyl)anilino]acetic acid
| Molecular Formula | C19H25NO4S |
|---|---|
| Molecular Weight | 363.15 g/mol |
| LogP | 3.005 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.15042 |
| Heavy Atoms | 25 |
| Complexity | 748.86285 |
Chemical Identifiers
| CAS Number | 592473-65-9 |
|---|---|
| SMILES | CS(=O)(=O)N(CC(=O)O)C1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3 |
Product Overview
2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid (CAS 592473-65-9), with molecular formula C19H25NO4S and molecular weight 363.15 g/mol. IUPAC: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid.
Chemical Property Profile of 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid
Property Insights of 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid
The XLogP value of 3.005 indicates that 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid. Following Lipinski's Rule of Five, 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid has 1 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 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid?
The CAS number of 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid is 592473-65-9.
What is the molecular formula of 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid?
The molecular formula of 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid is C19H25NO4S.
What is the molecular weight of 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid?
The molecular weight of 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid is 363.15 g/mol.
Where can I buy 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid?
You can request a quote for 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic 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-(1-adamantyl)-N-methylsulfonylanilino]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(1-adamantyl)-N-methylsulfonylanilino]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.