2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo-
TL;DR: 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo- (CAS 17796-71-3) is a chemical compound with molecular formula C11H11NO2S and molecular weight 221.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-propylsulfanylisoindole-1,3-dione
Also Known As: Phthaloyl MPA, 3-Mercaptopropylphthalimide, N-propylthiophthalimide, N-(Propylthio)phthalimide, 2-propylsulfanylisoindole-1,3-dione
| Molecular Formula | C11H11NO2S |
|---|---|
| Molecular Weight | 221.05 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.05106 |
| Heavy Atoms | 15 |
| Complexity | 256.0 |
Chemical Identifiers
| CAS Number | 17796-71-3 |
|---|---|
| SMILES | CCCSN1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | AZFZZWPVIHWVOE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo- (CAS 17796-71-3), with molecular formula C11H11NO2S and molecular weight 221.05 g/mol. IUPAC: 2-propylsulfanylisoindole-1,3-dione.
Chemical Property Profile of 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo-
Property Insights of 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo-. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo-. Following Lipinski's Rule of Five, 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo- has 0 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 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo-?
The CAS number of 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo- is 17796-71-3.
What is the molecular formula of 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo-?
The molecular formula of 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo- is C11H11NO2S.
What is the molecular weight of 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo-?
The molecular weight of 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo- is 221.05 g/mol.
Where can I buy 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo-?
You can request a quote for 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo-?
Yes, KEHONG BIO provides custom synthesis services for 2H-Isoindole-2-propanethiol, 1,3-dihydro-1,3-dioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.