![3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid structure](/static/products/915/91570-07-9.png)
3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid
TL;DR: 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid (CAS 91570-07-9) 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.
3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic acid
Also Known As: HY-W474473, 3-(N-Phthalimidoylmethylthio)propanoic acid, 3-[(Phthalimidylmethyl)thio]propanoic acid, J1.543.831B, 3-(((1,3-Dioxoisoindolin-2-yl)methyl)thio)propanoic acid
| Molecular Formula | C12H11NO4S |
|---|---|
| Molecular Weight | 265.04 g/mol |
| LogP | 1.448 |
| Topological Polar Surface Area | 74.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 265.0409 |
| Heavy Atoms | 18 |
| Complexity | 479.5538 |
Chemical Identifiers
| CAS Number | 91570-07-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CSCCC(=O)O |
Product Overview
3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid (CAS 91570-07-9), with molecular formula C12H11NO4S and molecular weight 265.04 g/mol. IUPAC: 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic acid.
Chemical Property Profile of 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid
Property Insights of 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid
The XLogP value of 1.448 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid. The TPSA of 74.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid. Following Lipinski's Rule of Five, 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]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 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid?
The CAS number of 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid is 91570-07-9.
What is the molecular formula of 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid?
The molecular formula of 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid is C12H11NO4S.
What is the molecular weight of 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid?
The molecular weight of 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid is 265.04 g/mol.
Where can I buy 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid?
You can request a quote for 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(1,3-dioxoisoindol-2-yl)methylsulfanyl]propanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.