![N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine structure](/static/products/5016/501653-61-8.webp)
N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine
TL;DR: N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine (CAS 501653-61-8) 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-methylphenyl)methyl-methylsulfonylamino]acetic acid
Also Known As: N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine, N-(Methanesulfonyl)-N-[(3-methylphenyl)methyl]glycine, 2-[(3-methylphenyl)methyl-methylsulfonylamino]acetic acid
| Molecular Formula | C11H15NO4S |
|---|---|
| Molecular Weight | 257.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 257.07217 |
| Heavy Atoms | 17 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 501653-61-8 |
|---|---|
| SMILES | CC1=CC(=CC=C1)CN(CC(=O)O)S(=O)(=O)C |
| InChIKey | XWNCLQRSWSVJEU-UHFFFAOYSA-N |
Product Overview
N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine (CAS 501653-61-8), with molecular formula C11H15NO4S and molecular weight 257.07 g/mol. IUPAC: 2-[(3-methylphenyl)methyl-methylsulfonylamino]acetic acid.
Chemical Property Profile of N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine
Property Insights of N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine. Following Lipinski's Rule of Five, N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine has 1 hydrogen bond donor(s) and 5 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-Methylphenyl)methyl]-N-(methylsulfonyl)glycine?
The CAS number of N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine is 501653-61-8.
What is the molecular formula of N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine?
The molecular formula of N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine is C11H15NO4S.
What is the molecular weight of N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine?
The molecular weight of N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine is 257.07 g/mol.
Where can I buy N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine?
You can request a quote for N-[(3-Methylphenyl)methyl]-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-Methylphenyl)methyl]-N-(methylsulfonyl)glycine?
Yes, KEHONG BIO provides custom synthesis services for N-[(3-Methylphenyl)methyl]-N-(methylsulfonyl)glycine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.