2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one

C20H10F4N2O2 — CID 16749938

IUPAC2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one
SMILESO=c1ccn2nc(Oc3ccc(F)cc3F)ccc2c1-c1c(F)cccc1F
InChIInChI=1S/C20H10F4N2O2/c21-11-4-6-17(14(24)10-11)28-18-7-5-15-20(16(27)8-9-26(15)25-18)19-12(22)2-1-3-13(19)23/h1-10H
InChIKeySOVZJLPDHNBNIT-UHFFFAOYSA-N
MW386.30 g/mol
LogP4.71
Rot. Bonds3

About 2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one

2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one (PubChem CID 16749938) has the molecular formula C20H10F4N2O2 and a molecular weight of 386.30 g/mol. Its IUPAC name is 2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one.

Molecular Properties

Compound Name2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one
PubChem CID16749938
Molecular FormulaC20H10F4N2O2
Molecular Weight386.30 g/mol
Exact Mass386.07
IUPAC Name2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one
SMILESO=c1ccn2nc(Oc3ccc(F)cc3F)ccc2c1-c1c(F)cccc1F
InChIInChI=1S/C20H10F4N2O2/c21-11-4-6-17(14(24)10-11)28-18-7-5-15-20(16(27)8-9-26(15)25-18)19-12(22)2-1-3-13(19)23/h1-10H
InChIKeySOVZJLPDHNBNIT-UHFFFAOYSA-N
XLogP4.71
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.30
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one?
The IUPAC name of 2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one (CID 16749938) is 2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one.
What is the SMILES notation for 2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one?
The canonical SMILES for 2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one is O=c1ccn2nc(Oc3ccc(F)cc3F)ccc2c1-c1c(F)cccc1F.
What is the InChIKey of 2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one?
The InChIKey is SOVZJLPDHNBNIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H10F4N2O2/c21-11-4-6-17(14(24)10-11)28-18-7-5-15-20(16(27)8-9-26(15)25-18)19-12(22)2-1-3-13(19)23/h1-10H.
What are the key properties of 2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one?
2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one has a molecular weight of 386.30 g/mol, XLogP of 4.71, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenoxy)-5-(2,6-difluorophenyl)pyrido[1,2-b]pyridazin-6-one is sourced from PubChem (CID 16749938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).