3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine

C20H20N2O4 — CID 172676310

IUPAC3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine
SMILESCOc1ccc(-c2nnccc2-c2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C20H20N2O4/c1-23-15-7-5-13(6-8-15)19-16(9-10-21-22-19)14-11-17(24-2)20(26-4)18(12-14)25-3/h5-12H,1-4H3
InChIKeyFLPCHOZHEYSTLP-UHFFFAOYSA-N
MW352.39 g/mol
LogP3.85
Rot. Bonds6

About 3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine

3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine (PubChem CID 172676310) has the molecular formula C20H20N2O4 and a molecular weight of 352.39 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine
PubChem CID172676310
Molecular FormulaC20H20N2O4
Molecular Weight352.39 g/mol
Exact Mass352.14
IUPAC Name3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine
SMILESCOc1ccc(-c2nnccc2-c2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C20H20N2O4/c1-23-15-7-5-13(6-8-15)19-16(9-10-21-22-19)14-11-17(24-2)20(26-4)18(12-14)25-3/h5-12H,1-4H3
InChIKeyFLPCHOZHEYSTLP-UHFFFAOYSA-N
XLogP3.85
TPSA62.70 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

3,6-bis(4-methylphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine
CID 18874648
4-[4-(4-methoxyphenyl)phenyl]-5-(3,4,5-trimethoxyphenyl)-2H-triazole
CID 59430230
3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)thiophene
CID 53388353
3-(4-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)pyridine
CID 126672991
2-amino-4-(4-methoxyphenyl)-6-(3,4,5-trimethoxyphenyl)pyridine-3-carbonitrile
CID 70111563
4-(4-methoxyphenyl)-2-pyridin-2-yl-6-(3,4,5-trimethoxyphenyl)pyrimidine
CID 90680976
3,4-bis(4-methoxyphenyl)-6-methylsulfanylpyridazine
CID 18760018
5-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)-1H-imidazol-2-amine
CID 132548516
6,7,8-trimethoxy-1-(4-methoxyphenyl)-4,5-dihydro-3H-benzo[e]indazole
CID 137348793
4-(4-methoxyphenyl)-3-(3,4,5-trimethoxyphenyl)-1,2-oxazol-5-amine
CID 46227182
3-(4-methoxyphenyl)-6-(3,4,5-trimethoxyphenyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 162667738
3-(4-methoxyphenyl)-5-(3,4,5-trimethoxyphenyl)-1,2-thiazole
CID 91024089

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine?
The IUPAC name of 3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine (CID 172676310) is 3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine.
What is the SMILES notation for 3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine?
The canonical SMILES for 3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine is COc1ccc(-c2nnccc2-c2cc(OC)c(OC)c(OC)c2)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine?
The InChIKey is FLPCHOZHEYSTLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4/c1-23-15-7-5-13(6-8-15)19-16(9-10-21-22-19)14-11-17(24-2)20(26-4)18(12-14)25-3/h5-12H,1-4H3.
What are the key properties of 3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine?
3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine has a molecular weight of 352.39 g/mol, XLogP of 3.85, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-4-(3,4,5-trimethoxyphenyl)pyridazine is sourced from PubChem (CID 172676310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).