N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine
TL;DR: N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine (CAS 1008229-95-5) is a chemical compound with molecular formula C11H14ClNO5S and molecular weight 307.0281 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(5-chloro-2-methoxy-N-methylsulfonylanilino)propanoic acid
Also Known As: N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine, 2-(5-chloro-2-methoxy-N-methylsulfonylanilino)propanoic acid, 2-[N-(5-chloro-2-methoxyphenyl)methanesulfonamido]propanoic acid, alanine, N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)-, 2-[(5-chloro-2-methoxy-phenyl)-methylsulfonyl-amino]propanoic Acid
Technical Specifications
| Molecular Formula | C11H14ClNO5S |
| Molecular Weight | 307.0281 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 92.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.0281 Da |
| Heavy Atoms | 19 |
| Complexity | 421.0 |
| SMILES | CC(C(=O)O)N(C1=C(C=CC(=C1)Cl)OC)S(=O)(=O)C |
| InChIKey | FJRHBYIPMKFRIW-UHFFFAOYSA-N |
Chemical Property Profile of N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine
Property Insights of N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine. The TPSA of 92.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine. Following Lipinski's Rule of Five, N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine?
The CAS number of N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine is 1008229-95-5.
What is the molecular formula of N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine?
The molecular formula of N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine is C11H14ClNO5S.
What is the molecular weight of N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine?
The molecular weight of N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine is 307.0281 g/mol.
Where can I buy N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine?
You can request a quote for N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine?
Yes, CoreyChem provides custom synthesis services for N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)alanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.