6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine

C24H16N4O — CID 164825734

IUPAC6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine
SMILESCc1ccc(-c2nc3nnccc3n2-c2ccccc2)c2oc3ccccc3c12
InChIInChI=1S/C24H16N4O/c1-15-11-12-18(22-21(15)17-9-5-6-10-20(17)29-22)24-26-23-19(13-14-25-27-23)28(24)16-7-3-2-4-8-16/h2-14H,1H3
InChIKeyHKXOEFAOTNIMJB-UHFFFAOYSA-N
MW376.42 g/mol
LogP5.69
Rot. Bonds2

About 6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine

6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine (PubChem CID 164825734) has the molecular formula C24H16N4O and a molecular weight of 376.42 g/mol. Its IUPAC name is 6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine.

Molecular Properties

Compound Name6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine
PubChem CID164825734
Molecular FormulaC24H16N4O
Molecular Weight376.42 g/mol
Exact Mass376.13
IUPAC Name6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine
SMILESCc1ccc(-c2nc3nnccc3n2-c2ccccc2)c2oc3ccccc3c12
InChIInChI=1S/C24H16N4O/c1-15-11-12-18(22-21(15)17-9-5-6-10-20(17)29-22)24-26-23-19(13-14-25-27-23)28(24)16-7-3-2-4-8-16/h2-14H,1H3
InChIKeyHKXOEFAOTNIMJB-UHFFFAOYSA-N
XLogP5.69
TPSA56.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.42
LogP ≤ 55.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-methyldibenzofuran-4-yl)-1-phenylimidazo[4,5-b]pyridine
CID 164825150
6-tert-butyl-2-(1-methyldibenzofuran-4-yl)-1-phenylimidazo[4,5-b]pyridine
CID 164826244
7-methyl-2-(1-methyldibenzofuran-4-yl)-1-phenylimidazo[4,5-c]pyridine
CID 164826577
7-tert-butyl-2-(1-methyldibenzofuran-4-yl)-3-phenylimidazo[4,5-c]pyridine
CID 164825336
3-phenyl-2-[1-(trideuteriomethyl)dibenzofuran-4-yl]imidazo[4,5-c]pyridine
CID 156658601
6-(1-fluorodibenzofuran-4-yl)-5-phenylimidazo[4,5-e]tetrazine
CID 164824366
4-methyl-2-(1-methyldibenzofuran-4-yl)pyridine
CID 171576824
2-(1-fluorodibenzofuran-4-yl)-6-methyl-1-phenylimidazo[4,5-c]pyridine
CID 164825457
6-tert-butyl-2-dibenzofuran-4-yl-1-phenylimidazo[4,5-b]pyridine
CID 164826557
2-dibenzofuran-4-yl-3-phenylimidazo[4,5-c]pyridine
CID 156658408
1-dibenzofuran-4-yl-4-(1-methyldibenzofuran-4-yl)dibenzofuran
CID 153447937
2-(1-fluorodibenzofuran-4-yl)-4-methyl-1-phenylimidazo[4,5-c]quinoline
CID 164826690

Frequently Asked Questions

What is the IUPAC name of 6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine?
The IUPAC name of 6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine (CID 164825734) is 6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine.
What is the SMILES notation for 6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine?
The canonical SMILES for 6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine is Cc1ccc(-c2nc3nnccc3n2-c2ccccc2)c2oc3ccccc3c12.
What is the InChIKey of 6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine?
The InChIKey is HKXOEFAOTNIMJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16N4O/c1-15-11-12-18(22-21(15)17-9-5-6-10-20(17)29-22)24-26-23-19(13-14-25-27-23)28(24)16-7-3-2-4-8-16/h2-14H,1H3.
What are the key properties of 6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine?
6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine has a molecular weight of 376.42 g/mol, XLogP of 5.69, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methyldibenzofuran-4-yl)-5-phenylimidazo[4,5-c]pyridazine is sourced from PubChem (CID 164825734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).