S-(3-oxopropyl)-N-acetylcysteine
TL;DR: S-(3-oxopropyl)-N-acetylcysteine (CAS 140226-30-8) is a chemical compound with molecular formula C8H13NO4S and molecular weight 219.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-acetamido-3-(3-oxopropylsulfanyl)propanoic acid
Also Known As: Sopa-cys, S-(3-Oxopropyl)-N-acetylcysteine, N-acetyl-S-(3-oxopropyl)-L-Cysteine, S-(3-Oxopropyl)-N-acetyl-L-cysteine, L-Cysteine,N-acetyl-S-(3-oxopropyl)-
| Molecular Formula | C8H13NO4S |
|---|---|
| Molecular Weight | 219.06 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 219.05653 |
| Heavy Atoms | 14 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 140226-30-8 |
|---|---|
| SMILES | CC(=O)N[C@@H](CSCCC=O)C(=O)O |
| InChIKey | OOMVCGSUXLINOO-ZETCQYMHSA-N |
Product Overview
S-(3-oxopropyl)-N-acetylcysteine (CAS 140226-30-8), with molecular formula C8H13NO4S and molecular weight 219.06 g/mol. IUPAC: (2R)-2-acetamido-3-(3-oxopropylsulfanyl)propanoic acid.
Chemical Property Profile of S-(3-oxopropyl)-N-acetylcysteine
Property Insights of S-(3-oxopropyl)-N-acetylcysteine
The XLogP value of -0.7 indicates that S-(3-oxopropyl)-N-acetylcysteine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(3-oxopropyl)-N-acetylcysteine. Following Lipinski's Rule of Five, S-(3-oxopropyl)-N-acetylcysteine has 2 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-(3-oxopropyl)-N-acetylcysteine?
The CAS number of S-(3-oxopropyl)-N-acetylcysteine is 140226-30-8.
What is the molecular formula of S-(3-oxopropyl)-N-acetylcysteine?
The molecular formula of S-(3-oxopropyl)-N-acetylcysteine is C8H13NO4S.
What is the molecular weight of S-(3-oxopropyl)-N-acetylcysteine?
The molecular weight of S-(3-oxopropyl)-N-acetylcysteine is 219.06 g/mol.
Where can I buy S-(3-oxopropyl)-N-acetylcysteine?
You can request a quote for S-(3-oxopropyl)-N-acetylcysteine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(3-oxopropyl)-N-acetylcysteine?
Yes, KEHONG BIO provides custom synthesis services for S-(3-oxopropyl)-N-acetylcysteine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.