6-chloro-8-((4-methoxybenzyl)(phenyl)amino)-N-(2-methylpyridin-4-yl)imidazo[1,2-b]pyridazine-3-carboxamide

HCID 59624628
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Basic information

Standard SMILES
COc1ccc(CN(c2ccccc2)c2cc(Cl)nn3c(C(=O)Nc4ccnc(C)c4)cnc23)cc1
InChIKey
BRPYQEGRAHKANN-UHFFFAOYSA-N
Molecular formula
C27H23ClN6O2
Average molar mass
499 g/mol
Monoisotopic mass
498.1571017

Names & identifiers

Preferred name
6-chloro-8-((4-methoxybenzyl)(phenyl)amino)-N-(2-methylpyridin-4-yl)imidazo[1,2-b]pyridazine-3-carboxamide
IUPAC
6-chloro-8-[N-[(4-methoxyphenyl)methyl]anilino]-N-(2-methyl-4-pyridinyl)imidazo[1,2-b]pyridazine-3-carboxamide

Names & synonyms

SCHEMBL3717107BRPYQEGRAHKANN-UHFFFAOYSA-N6-chloro-8-((4-methoxybenzyl)(phenyl)amino)-N-(2-methylpyridin-4-yl)imidazo[1,2-b]pyridazine-3-carboxamide

Database identifiers

PubChem CID
59624628

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
84.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
36

Related reactions

3 records
New reaction record

Compound notes

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