N-Acetylhomocysteine
TL;DR: N-Acetylhomocysteine (CAS 55585-92-7) is a chemical compound with molecular formula C6H11NO3S and molecular weight 177.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-4-sulfanylbutanoic acid
Also Known As: N-Acetyl-DL-homocysteine, citiolone, Acetyl-homocysteine, N-Acetylhomocysteine, Uvitex EFT
| Molecular Formula | C6H11NO3S |
|---|---|
| Molecular Weight | 177.05 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 177.04596 |
| Heavy Atoms | 11 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 55585-92-7 |
|---|---|
| SMILES | CC(=O)NC(CCS)C(=O)O |
| InChIKey | REYLLNRLWCBKCM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Acetylhomocysteine (CAS 55585-92-7), with molecular formula C6H11NO3S and molecular weight 177.05 g/mol. IUPAC: 2-acetamido-4-sulfanylbutanoic acid.
Chemical Property Profile of N-Acetylhomocysteine
Property Insights of N-Acetylhomocysteine
The XLogP value of -0.3 indicates that N-Acetylhomocysteine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Acetylhomocysteine. Following Lipinski's Rule of Five, N-Acetylhomocysteine has 3 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-Acetylhomocysteine?
The CAS number of N-Acetylhomocysteine is 55585-92-7.
What is the molecular formula of N-Acetylhomocysteine?
The molecular formula of N-Acetylhomocysteine is C6H11NO3S.
What is the molecular weight of N-Acetylhomocysteine?
The molecular weight of N-Acetylhomocysteine is 177.05 g/mol.
Where can I buy N-Acetylhomocysteine?
You can request a quote for N-Acetylhomocysteine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Acetylhomocysteine?
Yes, KEHONG BIO provides custom synthesis services for N-Acetylhomocysteine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.