![2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione structure](/static/products/896/896830-83-4.png)
2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione
TL;DR: 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione (CAS 896830-83-4) is a chemical compound with molecular formula C23H24FN3O3 and molecular weight 409.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluorophenyl)-3-hydroxy-4-(3-morpholin-4-ylpropyliminomethyl)isoquinolin-1-one
Also Known As: 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione, (4E)-2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione, (4E)-2-(4-fluorophenyl)-4-({[3-(morpholin-4-yl)propyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione, (E)-2-(4-fluorophenyl)-4-(((3-morpholinopropyl)amino)methylene)isoquinoline-1,3(2H,4H)-dione
| Molecular Formula | C23H24FN3O3 |
|---|---|
| Molecular Weight | 409.18 g/mol |
| LogP | 2.9766 |
| Topological Polar Surface Area | 67.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.18018 |
| Heavy Atoms | 30 |
| Complexity | 1103.1167 |
Chemical Identifiers
| CAS Number | 896830-83-4 |
|---|---|
| SMILES | C1COCCN1CCCN=CC2=C(N(C(=O)C3=CC=CC=C32)C4=CC=C(C=C4)F)O |
Product Overview
2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione (CAS 896830-83-4), with molecular formula C23H24FN3O3 and molecular weight 409.18 g/mol. IUPAC: 2-(4-fluorophenyl)-3-hydroxy-4-(3-morpholin-4-ylpropyliminomethyl)isoquinolin-1-one.
Chemical Property Profile of 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione
Property Insights of 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione
The XLogP value of 2.9766 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione. The TPSA of 67.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione. Following Lipinski's Rule of Five, 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione has 1 hydrogen bond donor(s) and 5 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 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione?
The CAS number of 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione is 896830-83-4.
What is the molecular formula of 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione?
The molecular formula of 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione is C23H24FN3O3.
What is the molecular weight of 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione?
The molecular weight of 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione is 409.18 g/mol.
Where can I buy 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione?
You can request a quote for 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]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 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-fluorophenyl)-4-[(3-morpholin-4-ylpropylamino)methylidene]isoquinoline-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.