Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl-
TL;DR: Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl- (CAS 25506-06-3) is a chemical compound with molecular formula C11H7N3O2 and molecular weight 213.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-phenyl-6H-[1,2]oxazolo[3,4-d]pyridazin-7-one
Also Known As: 4-Fenilisossazalo(3,4-d)piridazin-7-one, 4-Phenylisoxazolo(3,4-d)pyridazin-7(6H)-one, ISOXAZOLO(3,4-d)PYRIDAZIN-7(6H)-ONE, 4-PHENYL-, 4-Fenilisossazalo(3,4-d)piridazin-7-one [Italian], 4-Phenylisoxazolo[3,4-d]pyridazin-7(6H)-one
| Molecular Formula | C11H7N3O2 |
|---|---|
| Molecular Weight | 213.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 67.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 213.05383 |
| Heavy Atoms | 16 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 25506-06-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NNC(=O)C3=NOC=C23 |
| InChIKey | GXRAZEHWDPPKRU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl- (CAS 25506-06-3), with molecular formula C11H7N3O2 and molecular weight 213.05 g/mol. IUPAC: 4-phenyl-6H-[1,2]oxazolo[3,4-d]pyridazin-7-one.
Chemical Property Profile of Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl-
Property Insights of Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl-
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl-. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl-. Following Lipinski's Rule of Five, Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl- has 1 hydrogen bond donor(s) and 4 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 Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl-?
The CAS number of Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl- is 25506-06-3.
What is the molecular formula of Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl-?
The molecular formula of Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl- is C11H7N3O2.
What is the molecular weight of Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl-?
The molecular weight of Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl- is 213.05 g/mol.
Where can I buy Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl-?
You can request a quote for Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Isoxazolo(3,4-d)pyridazin-7(6H)-one, 4-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.