![4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione structure](/static/products/900/900258-97-1.png)
4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione
TL;DR: 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione (CAS 900258-97-1) is a chemical compound with molecular formula C25H31N3O2 and molecular weight 405.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-(diethylamino)propyliminomethyl]-2-(2,6-dimethylphenyl)-3-hydroxyisoquinolin-1-one
Also Known As: 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione, 4-[3-(diethylamino)propyliminomethyl]-2-(2,6-dimethylphenyl)-3-hydroxyisoquinolin-1-one, 4-[(3-diethylaminopropylamino)methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione, (4E)-4-({[3-(diethylamino)propyl]amino}methylidene)-2-(2,6-dimethylphenyl)isoquinoline-1,3(2H,4H)-dione, (4E)-4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione
| Molecular Formula | C25H31N3O2 |
|---|---|
| Molecular Weight | 405.24 g/mol |
| LogP | 4.46394 |
| Topological Polar Surface Area | 57.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 405.24164 |
| Heavy Atoms | 30 |
| Complexity | 1091.0623 |
Chemical Identifiers
| CAS Number | 900258-97-1 |
|---|---|
| SMILES | CCN(CC)CCCN=CC1=C(N(C(=O)C2=CC=CC=C21)C3=C(C=CC=C3C)C)O |
Product Overview
4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione (CAS 900258-97-1), with molecular formula C25H31N3O2 and molecular weight 405.24 g/mol. IUPAC: 4-[3-(diethylamino)propyliminomethyl]-2-(2,6-dimethylphenyl)-3-hydroxyisoquinolin-1-one.
Chemical Property Profile of 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione
Property Insights of 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione
The XLogP value of 4.46394 indicates that 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.83 Ų, 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione 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 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione?
The CAS number of 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione is 900258-97-1.
What is the molecular formula of 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione?
The molecular formula of 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione is C25H31N3O2.
What is the molecular weight of 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione?
The molecular weight of 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione is 405.24 g/mol.
Where can I buy 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione?
You can request a quote for 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)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-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 4-[[3-(diethylamino)propylamino]methylidene]-2-(2,6-dimethylphenyl)isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.