N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine
TL;DR: N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine (CAS 838876-58-7) is a chemical compound with molecular formula C14H11ClFNO4S and molecular weight 343.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[N-(benzenesulfonyl)-3-chloro-4-fluoroanilino]acetic acid
Also Known As: N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine, 2-[N-(benzenesulfonyl)-3-chloro-4-fluoroanilino]acetic acid, glycine, N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)-, 2-[N-(3-chloro-4-fluorophenyl)benzenesulfonamido]acetic acid, 2-[benzenesulfonyl-(3-chloro-4-fluoro-phenyl)amino]acetic Acid
| Molecular Formula | C14H11ClFNO4S |
|---|---|
| Molecular Weight | 343.01 g/mol |
| LogP | 2.759 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 343.00815 |
| Heavy Atoms | 22 |
| Complexity | 795.74506 |
Chemical Identifiers
| CAS Number | 838876-58-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)O)C2=CC(=C(C=C2)F)Cl |
Product Overview
N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine (CAS 838876-58-7), with molecular formula C14H11ClFNO4S and molecular weight 343.01 g/mol. IUPAC: 2-[N-(benzenesulfonyl)-3-chloro-4-fluoroanilino]acetic acid.
Chemical Property Profile of N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine
Property Insights of N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine
The XLogP value of 2.759 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine. Following Lipinski's Rule of Five, N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)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-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine?
The CAS number of N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine is 838876-58-7.
What is the molecular formula of N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine?
The molecular formula of N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine is C14H11ClFNO4S.
What is the molecular weight of N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine?
The molecular weight of N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine is 343.01 g/mol.
Where can I buy N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine?
You can request a quote for N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)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-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-4-fluorophenyl)-N-(phenylsulfonyl)glycine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.