4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one
TL;DR: 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one (CAS 4949-18-2) is a chemical compound with molecular formula C8H7N3O2 and molecular weight 177.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hydroxy-3-imino-1H-quinoxalin-2-one
Also Known As: 4-hydroxy-3-imino-1H-quinoxalin-2-one, 3-amino-2-hydroxyquinoxaline 4-oxide, 1-N-Oxi-2-amino-3-hydroxy-chinoxalin, 2(1H)-Quinoxalinone,3-amino-, 4-oxide, 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one
| Molecular Formula | C8H7N3O2 |
|---|---|
| Molecular Weight | 177.05 g/mol |
| LogP | 0.04637 |
| Topological Polar Surface Area | 81.87 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 177.05383 |
| Heavy Atoms | 13 |
| Complexity | 567.34625 |
Chemical Identifiers
| CAS Number | 4949-18-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=O)C(=N)N2O |
Product Overview
4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one (CAS 4949-18-2), with molecular formula C8H7N3O2 and molecular weight 177.05 g/mol. IUPAC: 4-hydroxy-3-imino-1H-quinoxalin-2-one.
Chemical Property Profile of 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one
Property Insights of 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one
The XLogP value of 0.04637 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one. The TPSA of 81.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one. Following Lipinski's Rule of Five, 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one has 3 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 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one?
The CAS number of 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one is 4949-18-2.
What is the molecular formula of 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one?
The molecular formula of 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one is C8H7N3O2.
What is the molecular weight of 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one?
The molecular weight of 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one is 177.05 g/mol.
Where can I buy 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one?
You can request a quote for 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-3-imino-3,4-dihydroquinoxalin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.