N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine
TL;DR: N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine (CAS 425617-51-2) is a chemical compound with molecular formula C12H17NO4S and molecular weight 271.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(N-methylsulfonyl-4-propan-2-ylanilino)acetic acid
Also Known As: N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine, BAS 02148046, 2-(N-methylsulfonyl-4-propan-2-ylanilino)acetic acid, 2-(4-isopropyl-N-methylsulfonyl-anilino)acetic acid, glycine, N-[4-(1-methylethyl)phenyl]-N-(methylsulfonyl)-
| Molecular Formula | C12H17NO4S |
|---|---|
| Molecular Weight | 271.09 g/mol |
| LogP | 1.6606 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 271.08783 |
| Heavy Atoms | 18 |
| Complexity | 519.5133 |
Chemical Identifiers
| CAS Number | 425617-51-2 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)N(CC(=O)O)S(=O)(=O)C |
Product Overview
N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine (CAS 425617-51-2), with molecular formula C12H17NO4S and molecular weight 271.09 g/mol. IUPAC: 2-(N-methylsulfonyl-4-propan-2-ylanilino)acetic acid.
Chemical Property Profile of N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine
Property Insights of N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine
The XLogP value of 1.6606 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine. Following Lipinski's Rule of Five, N-(4-Isopropylphenyl)-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-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine?
The CAS number of N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine is 425617-51-2.
What is the molecular formula of N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine?
The molecular formula of N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine is C12H17NO4S.
What is the molecular weight of N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine?
The molecular weight of N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine is 271.09 g/mol.
Where can I buy N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine?
You can request a quote for N-(4-Isopropylphenyl)-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-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Isopropylphenyl)-N-(methylsulfonyl)glycine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.