S-methyl-N-acetylpenicillamine
TL;DR: S-methyl-N-acetylpenicillamine (CAS 34297-29-5) is a chemical compound with molecular formula C8H15NO3S and molecular weight 205.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-acetamido-3-methyl-3-methylsulfanylbutanoic acid
Also Known As: S-Methyl-N-acetylpenicillamine, Valine,N-acetyl-3-(methylthio)-, DL-Valine, N-acetyl-3-(methylthio)-, N-Acetyl-3-(methylsulfanyl)-L-valine, (2R)-2-acetamido-3-methyl-3-methylsulfanylbutanoic acid
| Molecular Formula | C8H15NO3S |
|---|---|
| Molecular Weight | 205.08 g/mol |
| LogP | 0.7173 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 205.07727 |
| Heavy Atoms | 13 |
| Complexity | 215.43468 |
Chemical Identifiers
| CAS Number | 34297-29-5 |
|---|---|
| SMILES | CC(=O)N[C@H](C(=O)O)C(C)(C)SC |
Product Overview
S-methyl-N-acetylpenicillamine (CAS 34297-29-5), with molecular formula C8H15NO3S and molecular weight 205.08 g/mol. IUPAC: (2R)-2-acetamido-3-methyl-3-methylsulfanylbutanoic acid.
Chemical Property Profile of S-methyl-N-acetylpenicillamine
Property Insights of S-methyl-N-acetylpenicillamine
The XLogP value of 0.7173 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-methyl-N-acetylpenicillamine. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for S-methyl-N-acetylpenicillamine. Following Lipinski's Rule of Five, S-methyl-N-acetylpenicillamine 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-methyl-N-acetylpenicillamine?
The CAS number of S-methyl-N-acetylpenicillamine is 34297-29-5.
What is the molecular formula of S-methyl-N-acetylpenicillamine?
The molecular formula of S-methyl-N-acetylpenicillamine is C8H15NO3S.
What is the molecular weight of S-methyl-N-acetylpenicillamine?
The molecular weight of S-methyl-N-acetylpenicillamine is 205.08 g/mol.
Where can I buy S-methyl-N-acetylpenicillamine?
You can request a quote for S-methyl-N-acetylpenicillamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-methyl-N-acetylpenicillamine?
Yes, KEHONG BIO provides custom synthesis services for S-methyl-N-acetylpenicillamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.