6-Chloro-8-((4-methoxybenzyl)(phenyl)amino)imidazo[1,2-b]pyridazine-3-carboxylic acid

HCID 59624883

Basic information

Standard SMILES
COc1ccc(CN(c2ccccc2)c2cc(Cl)nn3c(C(=O)O)cnc23)cc1
InChIKey
QINCIUNDSAOHBD-UHFFFAOYSA-N
Molecular formula
C21H17ClN4O3
Average molar mass
408.8 g/mol

Names & identifiers

Preferred name
6-Chloro-8-((4-methoxybenzyl)(phenyl)amino)imidazo[1,2-b]pyridazine-3-carboxylic acid
IUPAC
6-chloro-8-[N-[(4-methoxyphenyl)methyl]anilino]imidazo[1,2-b]pyridazine-3-carboxylic acid

Names & synonyms

SCHEMBL3017547QINCIUNDSAOHBD-UHFFFAOYSA-N6-chloro-8-((4-methoxybenzyl)(phenyl)amino) imidazo[1,2-b]pyridazine-3-carboxylic acid6-chloro-8-((4-methoxybenzyl)(phenyl)amino)-imidazo[1,2-b]pyridazine-3-carboxylic acid6-chloro-8-((4-methoxybenzyl)(phenyl)amino)imidazo[1,2-b]pyridazine-3-carboxylic acid

Database identifiers

PubChem CID
59624883

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
80 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
29

Related reactions

12 records

Compound notes

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