quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate
TL;DR: quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate (CAS 2390101-12-7) is a chemical compound with molecular formula C22H22N2O4S and molecular weight 410.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
quinolin-8-yl (2S)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoate
Also Known As: quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate, quinolin-8-yl (2S)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoate
| Molecular Formula | C22H22N2O4S |
|---|---|
| Molecular Weight | 410.13 g/mol |
| LogP | 3.7551 |
| Topological Polar Surface Area | 85.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 410.13004 |
| Heavy Atoms | 29 |
| Complexity | 1120.5221 |
Chemical Identifiers
| CAS Number | 2390101-12-7 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)OC1=CC=CC2=C1N=CC=C2)NS(=O)(=O)/C=C/C3=CC=CC=C3 |
Product Overview
quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate (CAS 2390101-12-7), with molecular formula C22H22N2O4S and molecular weight 410.13 g/mol. IUPAC: quinolin-8-yl (2S)-3-methyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanoate.
Chemical Property Profile of quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate
Property Insights of quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate
The XLogP value of 3.7551 indicates that quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.36 Ų falls within the moderate polarity range, balancing permeability and solubility for quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate. Following Lipinski's Rule of Five, quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate 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 quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate?
The CAS number of quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate is 2390101-12-7.
What is the molecular formula of quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate?
The molecular formula of quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate is C22H22N2O4S.
What is the molecular weight of quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate?
The molecular weight of quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate is 410.13 g/mol.
Where can I buy quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate?
You can request a quote for quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate?
Yes, KEHONG BIO provides custom synthesis services for quinolin-8-yl (2S)-3-methyl-2-(2-phenylethenesulfonamido)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.