3-(4-Carbomethoxyphenyl)-6-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-pyridazine

HCID 14726548
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Basic information

Standard SMILES
COC(=O)c1ccc(-c2ccc(-c3ccc4c(c3)C(C)(C)CCC4(C)C)nn2)cc1
InChIKey
CKGCAMFBNOAVKQ-UHFFFAOYSA-N
Molecular formula
C26H28N2O2
Average molar mass
400.5 g/mol
Monoisotopic mass
400.21507814

Names & identifiers

Preferred name
3-(4-Carbomethoxyphenyl)-6-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-pyridazine
IUPAC
methyl 4-[6-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)pyridazin-3-yl]benzoate

Names & synonyms

SCHEMBL8457129CKGCAMFBNOAVKQ-UHFFFAOYSA-N3-(4-Carbomethoxyphenyl)-6-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-pyridazine

Database identifiers

PubChem CID
14726548

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
52.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
30

Related reactions

4 records
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Compound notes

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