Butanoyl chloride, 2-amino-4-(methylthio)-
TL;DR: Butanoyl chloride, 2-amino-4-(methylthio)- (CAS 63729-69-1) is a chemical compound with molecular formula C5H10ClNOS and molecular weight 167.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-methylsulfanylbutanoyl chloride
Also Known As: Methionyl chloride, L-methionyl chloride, 2-amino-4-methylsulfanylbutanoyl chloride, Butanoyl chloride, 2-amino-4-(methylthio)-
| Molecular Formula | C5H10ClNOS |
|---|---|
| Molecular Weight | 167.02 g/mol |
| LogP | 0.8322 |
| Topological Polar Surface Area | 43.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 167.01717 |
| Heavy Atoms | 9 |
| Complexity | 98.958786 |
Chemical Identifiers
| CAS Number | 63729-69-1 |
|---|---|
| SMILES | CSCCC(C(=O)Cl)N |
Product Overview
Butanoyl chloride, 2-amino-4-(methylthio)- (CAS 63729-69-1), with molecular formula C5H10ClNOS and molecular weight 167.02 g/mol. IUPAC: 2-amino-4-methylsulfanylbutanoyl chloride.
Chemical Property Profile of Butanoyl chloride, 2-amino-4-(methylthio)-
Property Insights of Butanoyl chloride, 2-amino-4-(methylthio)-
The XLogP value of 0.8322 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanoyl chloride, 2-amino-4-(methylthio)-. With a topological polar surface area (TPSA) of 43.09 Ų, Butanoyl chloride, 2-amino-4-(methylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanoyl chloride, 2-amino-4-(methylthio)- has 1 hydrogen bond donor(s) and 3 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 Butanoyl chloride, 2-amino-4-(methylthio)-?
The CAS number of Butanoyl chloride, 2-amino-4-(methylthio)- is 63729-69-1.
What is the molecular formula of Butanoyl chloride, 2-amino-4-(methylthio)-?
The molecular formula of Butanoyl chloride, 2-amino-4-(methylthio)- is C5H10ClNOS.
What is the molecular weight of Butanoyl chloride, 2-amino-4-(methylthio)-?
The molecular weight of Butanoyl chloride, 2-amino-4-(methylthio)- is 167.02 g/mol.
Where can I buy Butanoyl chloride, 2-amino-4-(methylthio)-?
You can request a quote for Butanoyl chloride, 2-amino-4-(methylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoyl chloride, 2-amino-4-(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Butanoyl chloride, 2-amino-4-(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.