6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine

C24H18F2N2O3 — CID 18759999

IUPAC6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine
SMILESCOc1ccc(-c2cc(Oc3cc(F)cc(F)c3)nnc2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H18F2N2O3/c1-29-19-7-3-15(4-8-19)22-14-23(31-21-12-17(25)11-18(26)13-21)27-28-24(22)16-5-9-20(30-2)10-6-16/h3-14H,1-2H3
InChIKeyGLOIRRPJALTRST-UHFFFAOYSA-N
MW420.42 g/mol
LogP5.90
Rot. Bonds6

About 6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine

6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine (PubChem CID 18759999) has the molecular formula C24H18F2N2O3 and a molecular weight of 420.42 g/mol. Its IUPAC name is 6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine.

Molecular Properties

Compound Name6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine
PubChem CID18759999
Molecular FormulaC24H18F2N2O3
Molecular Weight420.42 g/mol
Exact Mass420.13
IUPAC Name6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine
SMILESCOc1ccc(-c2cc(Oc3cc(F)cc(F)c3)nnc2-c2ccc(OC)cc2)cc1
InChIInChI=1S/C24H18F2N2O3/c1-29-19-7-3-15(4-8-19)22-14-23(31-21-12-17(25)11-18(26)13-21)27-28-24(22)16-5-9-20(30-2)10-6-16/h3-14H,1-2H3
InChIKeyGLOIRRPJALTRST-UHFFFAOYSA-N
XLogP5.90
TPSA53.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.42
LogP ≤ 55.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(4-Methylphenoxy)-4-(4-methylphenyl)phthalazine
CID 6401676
3-(4-Methoxyphenoxy)-6-phenylpyridazine-4-carbonitrile
CID 6404525
3-Phenoxy-6-phenylpyridazine-4-carbonitrile
CID 6404526
1-(4-Methylphenoxy)-4-phenylphthalazine
CID 6413250
5,6-Bis(4-methoxyphenyl)pyridazine-3-carbonitrile
CID 9901502
3,4-Bis(4-methoxyphenyl)-6-(2-cyanophenoxy)pyridazine
CID 10112167
3,4-Bis(4-methoxyphenyl)-6-(2,3,5,6-tetrafluorophenoxy)pyridazine
CID 10115219
3,4-Bis(4-methoxyphenyl)-6(2,3,4,5,6-pentafluorophenoxy)pyridazine
CID 10140295
3,4-Bis(4-methoxyphenyl)-6-(3,4-difluorophenoxy)pyridazine
CID 10159092
3,4-Bis(4-methoxyphenyl)-6-(phenoxy)pyridazine
CID 10178057
3,4-Bis(4-methoxyphenyl)-6-(2,6-difluorophenoxy)pyridazine
CID 10223878
3,4-Bis(4-methoxyphenyl)-6-(4-nitrophenoxy)pyridazine
CID 10224533

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine?
The IUPAC name of 6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine (CID 18759999) is 6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine.
What is the SMILES notation for 6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine?
The canonical SMILES for 6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine is COc1ccc(-c2cc(Oc3cc(F)cc(F)c3)nnc2-c2ccc(OC)cc2)cc1.
What is the InChIKey of 6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine?
The InChIKey is GLOIRRPJALTRST-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18F2N2O3/c1-29-19-7-3-15(4-8-19)22-14-23(31-21-12-17(25)11-18(26)13-21)27-28-24(22)16-5-9-20(30-2)10-6-16/h3-14H,1-2H3.
What are the key properties of 6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine?
6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine has a molecular weight of 420.42 g/mol, XLogP of 5.90, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-difluorophenoxy)-3,4-bis(4-methoxyphenyl)pyridazine is sourced from PubChem (CID 18759999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).