S-(5-acetamido-2-hydroxyphenyl)cysteine
TL;DR: S-(5-acetamido-2-hydroxyphenyl)cysteine (CAS 37398-30-4) is a chemical compound with molecular formula C11H14N2O4S and molecular weight 270.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-acetamido-2-hydroxyphenyl)sulfanyl-2-aminopropanoic acid
Also Known As: Acetaminophen mercapturate, 3-(Cystein-S-yl)acetaminophen, 3-(Cystein-S-yl)paracetamol, paracetamol cysteine conjugate, cysteine S-acetaminophen conjugate
| Molecular Formula | C11H14N2O4S |
|---|---|
| Molecular Weight | 270.07 g/mol |
| LogP | 0.8546 |
| Topological Polar Surface Area | 112.65 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.0674 |
| Heavy Atoms | 18 |
| Complexity | 464.35648 |
Chemical Identifiers
| CAS Number | 37398-30-4 |
|---|---|
| SMILES | CC(=O)NC1=CC(=C(C=C1)O)SCC(C(=O)O)N |
Product Overview
S-(5-acetamido-2-hydroxyphenyl)cysteine (CAS 37398-30-4), with molecular formula C11H14N2O4S and molecular weight 270.07 g/mol. IUPAC: 3-(5-acetamido-2-hydroxyphenyl)sulfanyl-2-aminopropanoic acid.
Chemical Property Profile of S-(5-acetamido-2-hydroxyphenyl)cysteine
Property Insights of S-(5-acetamido-2-hydroxyphenyl)cysteine
The XLogP value of 0.8546 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(5-acetamido-2-hydroxyphenyl)cysteine. The TPSA of 112.65 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(5-acetamido-2-hydroxyphenyl)cysteine. Following Lipinski's Rule of Five, S-(5-acetamido-2-hydroxyphenyl)cysteine has 4 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 S-(5-acetamido-2-hydroxyphenyl)cysteine?
The CAS number of S-(5-acetamido-2-hydroxyphenyl)cysteine is 37398-30-4.
What is the molecular formula of S-(5-acetamido-2-hydroxyphenyl)cysteine?
The molecular formula of S-(5-acetamido-2-hydroxyphenyl)cysteine is C11H14N2O4S.
What is the molecular weight of S-(5-acetamido-2-hydroxyphenyl)cysteine?
The molecular weight of S-(5-acetamido-2-hydroxyphenyl)cysteine is 270.07 g/mol.
Where can I buy S-(5-acetamido-2-hydroxyphenyl)cysteine?
You can request a quote for S-(5-acetamido-2-hydroxyphenyl)cysteine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(5-acetamido-2-hydroxyphenyl)cysteine?
Yes, KEHONG BIO provides custom synthesis services for S-(5-acetamido-2-hydroxyphenyl)cysteine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.