N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine
TL;DR: N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine (CAS 36914-69-9) is a chemical compound with molecular formula C11H15NO4S and molecular weight 257.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethyl-N-methylsulfonylanilino)acetic acid
Also Known As: N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine, CBKinase1_000769, CBKinase1_013169, N-(3,4-Dimethylphenyl)-N-(methylsulfonyl)-glycine, 1-phenyl-2-(pyrazin-2-yl)ethanol
| Molecular Formula | C11H15NO4S |
|---|---|
| Molecular Weight | 257.07 g/mol |
| LogP | 1.15404 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 257.07217 |
| Heavy Atoms | 17 |
| Complexity | 536.40247 |
Chemical Identifiers
| CAS Number | 36914-69-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)N(CC(=O)O)S(=O)(=O)C)C |
Product Overview
N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine (CAS 36914-69-9), with molecular formula C11H15NO4S and molecular weight 257.07 g/mol. IUPAC: 2-(3,4-dimethyl-N-methylsulfonylanilino)acetic acid.
Chemical Property Profile of N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine
Property Insights of N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine
The XLogP value of 1.15404 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine. Following Lipinski's Rule of Five, N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine 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 N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine?
The CAS number of N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine is 36914-69-9.
What is the molecular formula of N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine?
The molecular formula of N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine is C11H15NO4S.
What is the molecular weight of N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine?
The molecular weight of N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine is 257.07 g/mol.
Where can I buy N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine?
You can request a quote for N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine?
Yes, KEHONG BIO provides custom synthesis services for N-(3,4-dimethylphenyl)-N-(methylsulfonyl)glycine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.