2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid
TL;DR: 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid (CAS 144889-50-9) is a chemical compound with molecular formula C9H17NO5S and molecular weight 251.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid
Also Known As: 1,2-Dihydroxybutylmercapturic acid, N-Acetyl-S-(3,4-dihydroxybutyl)-L-cysteine, L-Cysteine,N-acetyl-S-(3,4-dihydroxybutyl)-, 2-acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic Acid, N-Acetyl-S-(3,4-dihydroxybutyl)-L-cysteine (Mixture of Diastereomers)
| Molecular Formula | C9H17NO5S |
|---|---|
| Molecular Weight | 251.08 g/mol |
| LogP | -0.9478 |
| Topological Polar Surface Area | 106.86 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 251.08275 |
| Heavy Atoms | 16 |
| Complexity | 235.93924 |
Chemical Identifiers
| CAS Number | 144889-50-9 |
|---|---|
| SMILES | CC(=O)NC(CSCCC(CO)O)C(=O)O |
Product Overview
2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid (CAS 144889-50-9), with molecular formula C9H17NO5S and molecular weight 251.08 g/mol. IUPAC: 2-acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid.
Chemical Property Profile of 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid
Property Insights of 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid
The XLogP value of -0.9478 indicates that 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 106.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid. Following Lipinski's Rule of Five, 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid 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 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid?
The CAS number of 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid is 144889-50-9.
What is the molecular formula of 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid?
The molecular formula of 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid is C9H17NO5S.
What is the molecular weight of 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid?
The molecular weight of 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid is 251.08 g/mol.
Where can I buy 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid?
You can request a quote for 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Acetamido-3-(3,4-dihydroxybutylsulfanyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.