1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one
TL;DR: 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one (CAS 92647-07-9) is a chemical compound with molecular formula C15H17NO3 and molecular weight 259.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5-hydroxyhex-1-en-3-yl)-4H-isoquinoline-1,3-dione
Also Known As: Allylhydroxypropylhomophthalimide, Allilo-(beta-hydroksypropylo)-homoftalimid, Allilo-(beta-hydroksypropylo)-homoftalimid [Polish], 5-21-13-00223 (Beilstein Handbook Reference), 4-Allyl-4-(2-hydroxypropyl)-1,3(2H,4H)-isoquinolinedione
| Molecular Formula | C15H17NO3 |
|---|---|
| Molecular Weight | 259.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 259.12085 |
| Heavy Atoms | 19 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 92647-07-9 |
|---|---|
| SMILES | CC(CC(C=C)C1C2=CC=CC=C2C(=O)NC1=O)O |
| InChIKey | SMJFHPOAVXAXDR-UHFFFAOYSA-N |
Product Overview
1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one (CAS 92647-07-9), with molecular formula C15H17NO3 and molecular weight 259.12 g/mol. IUPAC: 4-(5-hydroxyhex-1-en-3-yl)-4H-isoquinoline-1,3-dione.
Chemical Property Profile of 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one
Property Insights of 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one. Following Lipinski's Rule of Five, 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one has 2 hydrogen bond donor(s) and 3 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-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one?
The CAS number of 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one is 92647-07-9.
What is the molecular formula of 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one?
The molecular formula of 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one is C15H17NO3.
What is the molecular weight of 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one?
The molecular weight of 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one is 259.12 g/mol.
Where can I buy 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one?
You can request a quote for 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Hydroxy-4-(5-hydroxyhex-1-en-3-yl)isoquinolin-3(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.