S-Methylpenicillamine
TL;DR: S-Methylpenicillamine (CAS 100217-05-8) is a chemical compound with molecular formula C6H13NO2S and molecular weight 163.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-amino-3-methyl-3-methylsulfanylbutanoic acid
Also Known As: S-Methylpenicillamine, penicillamine, S-methyl-, S-methyl-DL-penicillamine, L-Valine, 3-(methylthio)-, Valine, 3-(methylthio)-
| Molecular Formula | C6H13NO2S |
|---|---|
| Molecular Weight | 163.07 g/mol |
| LogP | 0.5399 |
| Topological Polar Surface Area | 63.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 163.0667 |
| Heavy Atoms | 10 |
| Complexity | 135.7095 |
Chemical Identifiers
| CAS Number | 100217-05-8 |
|---|---|
| SMILES | CC(C)([C@@H](C(=O)O)N)SC |
Product Overview
S-Methylpenicillamine (CAS 100217-05-8), with molecular formula C6H13NO2S and molecular weight 163.07 g/mol. IUPAC: (2R)-2-amino-3-methyl-3-methylsulfanylbutanoic acid.
Chemical Property Profile of S-Methylpenicillamine
Property Insights of S-Methylpenicillamine
The XLogP value of 0.5399 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-Methylpenicillamine. The TPSA of 63.32 Ų falls within the moderate polarity range, balancing permeability and solubility for S-Methylpenicillamine. Following Lipinski's Rule of Five, S-Methylpenicillamine has 2 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 S-Methylpenicillamine?
The CAS number of S-Methylpenicillamine is 100217-05-8.
What is the molecular formula of S-Methylpenicillamine?
The molecular formula of S-Methylpenicillamine is C6H13NO2S.
What is the molecular weight of S-Methylpenicillamine?
The molecular weight of S-Methylpenicillamine is 163.07 g/mol.
Where can I buy S-Methylpenicillamine?
You can request a quote for S-Methylpenicillamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-Methylpenicillamine?
Yes, KEHONG BIO provides custom synthesis services for S-Methylpenicillamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.