![4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione structure](/static/products/896/896833-07-1.png)
4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione
TL;DR: 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione (CAS 896833-07-1) is a chemical compound with molecular formula C25H31N3O4 and molecular weight 437.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(diethylamino)propyliminomethyl]-2-(2,4-dimethoxyphenyl)-3-hydroxyisoquinolin-1-one
Also Known As: 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione, 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione, (4E)-4-({[3-(diethylamino)propyl]amino}methylidene)-2-(2,4-dimethoxyphenyl)isoquinoline-1,3(2H,4H)-dione, (4E)-4-[[3-(diethylamino)propylamino]methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione, (E)-4-(((3-(diethylamino)propyl)amino)methylene)-2-(2,4-dimethoxyphenyl)isoquinoline-1,3(2H,4H)-dione
| Molecular Formula | C25H31N3O4 |
|---|---|
| Molecular Weight | 437.23 g/mol |
| LogP | 3.8643 |
| Topological Polar Surface Area | 76.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 437.23145 |
| Heavy Atoms | 32 |
| Complexity | 1149.8676 |
Chemical Identifiers
| CAS Number | 896833-07-1 |
|---|---|
| SMILES | CCN(CC)CCCN=CC1=C(N(C(=O)C2=CC=CC=C21)C3=C(C=C(C=C3)OC)OC)O |
Product Overview
4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione (CAS 896833-07-1), with molecular formula C25H31N3O4 and molecular weight 437.23 g/mol. IUPAC: 4-[3-(diethylamino)propyliminomethyl]-2-(2,4-dimethoxyphenyl)-3-hydroxyisoquinolin-1-one.
Chemical Property Profile of 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione
Property Insights of 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione
The XLogP value of 3.8643 indicates that 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione. Following Lipinski's Rule of Five, 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione has 1 hydrogen bond donor(s) and 6 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 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione?
The CAS number of 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione is 896833-07-1.
What is the molecular formula of 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione?
The molecular formula of 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione is C25H31N3O4.
What is the molecular weight of 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione?
The molecular weight of 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione is 437.23 g/mol.
Where can I buy 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione?
You can request a quote for 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-[(3-diethylaminopropylamino)methylidene]-2-(2,4-dimethoxyphenyl)isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.