4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo-
TL;DR: 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo- (CAS 82231-95-6) is a chemical compound with molecular formula C17H9F2N3O and molecular weight 309.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-bis(4-fluorophenyl)-6-oxo-1H-pyridazine-5-carbonitrile
Also Known As: 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo-, 5,6-Bis(4-fluorophenyl)-2,3-dihydro-3-oxo-4-pyridazinecarbonitrile, 3,4-bis(4-fluorophenyl)-6-oxo-1H-pyridazine-5-carbonitrile, 5,6-Bis(4-fluorophenyl)-3-oxo-2,3-dihydropyridazine-4-carbonitrile
| Molecular Formula | C17H9F2N3O |
|---|---|
| Molecular Weight | 309.07 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 65.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.07138 |
| Heavy Atoms | 23 |
| Complexity | 588.0 |
Chemical Identifiers
| CAS Number | 82231-95-6 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=C(C(=O)NN=C2C3=CC=C(C=C3)F)C#N)F |
| InChIKey | LEQVTXQNVDXMST-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo- (CAS 82231-95-6), with molecular formula C17H9F2N3O and molecular weight 309.07 g/mol. IUPAC: 3,4-bis(4-fluorophenyl)-6-oxo-1H-pyridazine-5-carbonitrile.
Chemical Property Profile of 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo-
Property Insights of 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo-
The XLogP value of 3.0 indicates that 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo-. Following Lipinski's Rule of Five, 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo- has 1 hydrogen bond donor(s) and 5 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-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo-?
The CAS number of 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo- is 82231-95-6.
What is the molecular formula of 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo-?
The molecular formula of 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo- is C17H9F2N3O.
What is the molecular weight of 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo-?
The molecular weight of 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo- is 309.07 g/mol.
Where can I buy 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo-?
You can request a quote for 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo-?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyridazinecarbonitrile, 5,6-bis(4-fluorophenyl)-2,3-dihydro-3-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.