2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid
TL;DR: 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid (CAS 55582-20-2) is a chemical compound with molecular formula C12H11NO4S and molecular weight 265.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dioxoisoindol-2-yl)-3-methylsulfanylpropanoic acid
Also Known As: 2- -3- PROPANOICACID, S-Methyl-N-phthaloyl-DL-cysteine, 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid, 2-(1,3-Dioxoisoindolin-2-yl)-3-(methylthio)propanoic acid, 2-Propenamide, N-[(2-chlorophenyl)methyl]-
| Molecular Formula | C12H11NO4S |
|---|---|
| Molecular Weight | 265.04 g/mol |
| LogP | 1.0988 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 265.0409 |
| Heavy Atoms | 18 |
| Complexity | 493.56363 |
Chemical Identifiers
| CAS Number | 55582-20-2 |
|---|---|
| SMILES | CSCC(C(=O)O)N1C(=O)C2=CC=CC=C2C1=O |
Product Overview
2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid (CAS 55582-20-2), with molecular formula C12H11NO4S and molecular weight 265.04 g/mol. IUPAC: 2-(1,3-dioxoisoindol-2-yl)-3-methylsulfanylpropanoic acid.
Chemical Property Profile of 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid
Property Insights of 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid
The XLogP value of 1.0988 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid. Following Lipinski's Rule of Five, 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid has 1 hydrogen bond donor(s) and 4 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-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid?
The CAS number of 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid is 55582-20-2.
What is the molecular formula of 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid?
The molecular formula of 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid is C12H11NO4S.
What is the molecular weight of 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid?
The molecular weight of 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid is 265.04 g/mol.
Where can I buy 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid?
You can request a quote for 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)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-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-(methylthio)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.