1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)-
TL;DR: 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)- (CAS 70007-65-7) is a chemical compound with molecular formula C14H17NO4S and molecular weight 295.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-2-(2-methylsulfonylethyl)isoquinoline-1,3-dione
Also Known As: 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)-, 4,4-Dimethyl-2-(2-methylsulfonylethyl)-2H,4H-isoquinoline-1,3-dione, 4,4-Dimethyl-2-(2-(methylsulfonyl)ethyl)-1,3(2H,4H)-isoquinolinedione, 4,4-dimethyl-2-(2-methylsulfonylethyl)isoquinoline-1,3-dione, 2-[2-(Methanesulfonyl)ethyl]-4,4-dimethylisoquinoline-1,3(2H,4H)-dione
| Molecular Formula | C14H17NO4S |
|---|---|
| Molecular Weight | 295.09 g/mol |
| LogP | 0.9912 |
| Topological Polar Surface Area | 71.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.08783 |
| Heavy Atoms | 20 |
| Complexity | 676.16925 |
Chemical Identifiers
| CAS Number | 70007-65-7 |
|---|---|
| SMILES | CC1(C2=CC=CC=C2C(=O)N(C1=O)CCS(=O)(=O)C)C |
Product Overview
1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)- (CAS 70007-65-7), with molecular formula C14H17NO4S and molecular weight 295.09 g/mol. IUPAC: 4,4-dimethyl-2-(2-methylsulfonylethyl)isoquinoline-1,3-dione.
Chemical Property Profile of 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)-
Property Insights of 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)-
The XLogP value of 0.9912 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)-. The TPSA of 71.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)-. Following Lipinski's Rule of Five, 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)- has 0 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 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)-?
The CAS number of 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)- is 70007-65-7.
What is the molecular formula of 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)-?
The molecular formula of 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)- is C14H17NO4S.
What is the molecular weight of 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)-?
The molecular weight of 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)- is 295.09 g/mol.
Where can I buy 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)-?
You can request a quote for 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-2-(2-(methylsulfonyl)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.