1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl-
TL;DR: 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl- (CAS 94164-60-0) is a chemical compound with molecular formula C18H19NO2 and molecular weight 281.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,4-tris(prop-2-enyl)isoquinoline-1,3-dione
Also Known As: alpha,alpha,N-Triallyl-homophtalimide, 2,4,4-Triallyl-1,3(2H,4H)-isoquinolinedione, 1,3(2H,4H)-ISOQUINOLINEDIONE, 2,4,4-TRIALLYL-, N-Allilo-imid kwasu alpha,alpha-dwuallilohomoftalowego [Polish], N-Allilo-imid kwasu alpha,alpha-dwuallilohomoftalowego
| Molecular Formula | C18H19NO2 |
|---|---|
| Molecular Weight | 281.14 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 281.14157 |
| Heavy Atoms | 21 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 94164-60-0 |
|---|---|
| SMILES | C=CCC1(C2=CC=CC=C2C(=O)N(C1=O)CC=C)CC=C |
| InChIKey | FDCHOOHVUTYHEP-UHFFFAOYSA-N |
Product Overview
1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl- (CAS 94164-60-0), with molecular formula C18H19NO2 and molecular weight 281.14 g/mol. IUPAC: 2,4,4-tris(prop-2-enyl)isoquinoline-1,3-dione.
Chemical Property Profile of 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl-
Property Insights of 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl-
The XLogP value of 3.5 indicates that 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.4 Ų, 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl- has 0 hydrogen bond donor(s) and 2 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, 2,4,4-triallyl-?
The CAS number of 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl- is 94164-60-0.
What is the molecular formula of 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl-?
The molecular formula of 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl- is C18H19NO2.
What is the molecular weight of 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl-?
The molecular weight of 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl- is 281.14 g/mol.
Where can I buy 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl-?
You can request a quote for 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl- 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, 2,4,4-triallyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3(2H,4H)-Isoquinolinedione, 2,4,4-triallyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.