2-hydroxyisoquinoline-1,3(2H,4H)-dione
TL;DR: 2-hydroxyisoquinoline-1,3(2H,4H)-dione (CAS 6890-08-0) is a chemical compound with molecular formula C9H7NO3 and molecular weight 177.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-4H-isoquinoline-1,3-dione
Also Known As: 2-hydroxyisoquinoline-1,3(2H,4H)-dione, 2-Hydroxy-4H-isoquinoline-1,3-dione, 2-Hydroxy-1,3(2H,4H)-isoquinolinedione, N-hydroxyisoquinolinedione, 2, 2-hydroxy-1,2,3,4-tetrahydroisoquinoline-1,3-dione
| Molecular Formula | C9H7NO3 |
|---|---|
| Molecular Weight | 177.04 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.04259 |
| Heavy Atoms | 13 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 6890-08-0 |
|---|---|
| SMILES | C1C2=CC=CC=C2C(=O)N(C1=O)O |
| InChIKey | ZXAICCBFIBBVAR-UHFFFAOYSA-N |
Product Overview
2-hydroxyisoquinoline-1,3(2H,4H)-dione (CAS 6890-08-0), with molecular formula C9H7NO3 and molecular weight 177.04 g/mol. IUPAC: 2-hydroxy-4H-isoquinoline-1,3-dione.
Chemical Property Profile of 2-hydroxyisoquinoline-1,3(2H,4H)-dione
Property Insights of 2-hydroxyisoquinoline-1,3(2H,4H)-dione
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-hydroxyisoquinoline-1,3(2H,4H)-dione. With a topological polar surface area (TPSA) of 57.6 Ų, 2-hydroxyisoquinoline-1,3(2H,4H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-hydroxyisoquinoline-1,3(2H,4H)-dione has 1 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 2-hydroxyisoquinoline-1,3(2H,4H)-dione?
The CAS number of 2-hydroxyisoquinoline-1,3(2H,4H)-dione is 6890-08-0.
What is the molecular formula of 2-hydroxyisoquinoline-1,3(2H,4H)-dione?
The molecular formula of 2-hydroxyisoquinoline-1,3(2H,4H)-dione is C9H7NO3.
What is the molecular weight of 2-hydroxyisoquinoline-1,3(2H,4H)-dione?
The molecular weight of 2-hydroxyisoquinoline-1,3(2H,4H)-dione is 177.04 g/mol.
Where can I buy 2-hydroxyisoquinoline-1,3(2H,4H)-dione?
You can request a quote for 2-hydroxyisoquinoline-1,3(2H,4H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-hydroxyisoquinoline-1,3(2H,4H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2-hydroxyisoquinoline-1,3(2H,4H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.