Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester)
TL;DR: Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester) (CAS 87459-76-5) is a chemical compound with molecular formula C15H19NO4S2 and molecular weight 341.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(3-benzoylsulfanylpropanoylamino)-4-methylsulfanylbutanoic acid
Also Known As: N-(3-Mercaptopropionyl)methionine thiobenzoate, DL-Methionine, N-(3-(benzoylthio)-1-oxopropyl)-, Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester), N-[3-(Benzoylsulfanyl)propanoyl]-L-methionine, (2S)-2-(3-benzoylsulfanylpropanoylamino)-4-methylsulfanylbutanoic acid
| Molecular Formula | C15H19NO4S2 |
|---|---|
| Molecular Weight | 341.08 g/mol |
| LogP | 2.2726 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 341.07556 |
| Heavy Atoms | 22 |
| Complexity | 507.52374 |
Chemical Identifiers
| CAS Number | 87459-76-5 |
|---|---|
| SMILES | CSCC[C@@H](C(=O)O)NC(=O)CCSC(=O)C1=CC=CC=C1 |
Product Overview
Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester) (CAS 87459-76-5), with molecular formula C15H19NO4S2 and molecular weight 341.08 g/mol. IUPAC: (2S)-2-(3-benzoylsulfanylpropanoylamino)-4-methylsulfanylbutanoic acid.
Chemical Property Profile of Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester)
Property Insights of Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester)
The XLogP value of 2.2726 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester). The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester). Following Lipinski's Rule of Five, Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester) has 2 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 Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester)?
The CAS number of Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester) is 87459-76-5.
What is the molecular formula of Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester)?
The molecular formula of Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester) is C15H19NO4S2.
What is the molecular weight of Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester)?
The molecular weight of Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester) is 341.08 g/mol.
Where can I buy Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester)?
You can request a quote for Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester)?
Yes, KEHONG BIO provides custom synthesis services for Methionine, N-(3-mercaptopropionyl)-, thiobenzoate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.