N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine
TL;DR: N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine (CAS 68671-93-2) is a chemical compound with molecular formula C11H9Cl4NO3S and molecular weight 374.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-3-(2,3,5,6-tetrachlorophenyl)sulfanylpropanoic acid
Also Known As: Lithium,(1,2-ethaned, N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine, N-acetyl-S-(2,3,5,6-tetrachlorophenyl)cysteine, DL-Cysteine, N-acetyl-S-(2,3,5,6-tetrachlorophenyl)-, Cysteine, N-acetyl-S-(2,3,5,6-tetrachlorophenyl)-
| Molecular Formula | C11H9Cl4NO3S |
|---|---|
| Molecular Weight | 374.91 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 91.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.90573 |
| Heavy Atoms | 20 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 68671-93-2 |
|---|---|
| SMILES | CC(=O)NC(CSC1=C(C(=CC(=C1Cl)Cl)Cl)Cl)C(=O)O |
| InChIKey | IHMPHNNJNNVWRA-UHFFFAOYSA-N |
Product Overview
N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine (CAS 68671-93-2), with molecular formula C11H9Cl4NO3S and molecular weight 374.91 g/mol. IUPAC: 2-acetamido-3-(2,3,5,6-tetrachlorophenyl)sulfanylpropanoic acid.
Chemical Property Profile of N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine
Property Insights of N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine
The XLogP value of 3.9 indicates that N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine. Following Lipinski's Rule of Five, N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine has 2 hydrogen bond donor(s) and 4 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-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine?
The CAS number of N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine is 68671-93-2.
What is the molecular formula of N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine?
The molecular formula of N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine is C11H9Cl4NO3S.
What is the molecular weight of N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine?
The molecular weight of N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine is 374.91 g/mol.
Where can I buy N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine?
You can request a quote for N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine?
Yes, KEHONG BIO provides custom synthesis services for N-Acetyl-S-(2,3,5,6-tetrachlorophenyl)-DL-cysteine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.