1,5-异喹啉二醇
TL;DR: 1,5-异喹啉二醇 (CAS 5154-02-9) is a chemical compound with molecular formula C9H7NO2 and molecular weight 161.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-异喹啉二醇
5-hydroxy-2H-isoquinolin-1-one
Also Known As: 1,5-isoquinolinediol, isoquinoline-1,5-diol, 1,5-Dihydroxyisoquinoline, isoquinolinediol, 5-HYDROXYISOQUINOLINE-1(2H)-ONE
| Molecular Formula | C9H7NO2 |
|---|---|
| Molecular Weight | 161.05 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 161.04768 |
| Heavy Atoms | 12 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 5154-02-9 |
|---|---|
| SMILES | C1=CC2=C(C=CNC2=O)C(=C1)O |
| InChIKey | LFUJIPVWTMGYDG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,5-异喹啉二醇 (CAS 5154-02-9), with molecular formula C9H7NO2 and molecular weight 161.05 g/mol. IUPAC: 5-hydroxy-2H-isoquinolin-1-one.
Chemical Property Profile of 1,5-异喹啉二醇
Property Insights of 1,5-异喹啉二醇
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,5-异喹啉二醇. With a topological polar surface area (TPSA) of 49.3 Ų, 1,5-异喹啉二醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-异喹啉二醇 has 2 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 1,5-异喹啉二醇?
The CAS number of 1,5-异喹啉二醇 is 5154-02-9.
What is the molecular formula of 1,5-异喹啉二醇?
The molecular formula of 1,5-异喹啉二醇 is C9H7NO2.
What is the molecular weight of 1,5-异喹啉二醇?
The molecular weight of 1,5-异喹啉二醇 is 161.05 g/mol.
Where can I buy 1,5-异喹啉二醇?
You can request a quote for 1,5-异喹啉二醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-异喹啉二醇?
Yes, KEHONG BIO provides custom synthesis services for 1,5-异喹啉二醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.