3-imidazo[1,2-b]pyridazin-7-yl-N-methylbenzamide

HCID 59443501

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: CNC(=O)c1cccc(-c2cnn3ccnc3c2)c1
InChIKey: KDZIIHNFLXZTGT-UHFFFAOYSA-N
Molecular formula: C14H12N4O
Average molar mass: 252.27 g/mol
Monoisotopic mass: 252.10111102

Names & identifiers

Preferred name: 3-imidazo[1,2-b]pyridazin-7-yl-N-methylbenzamide
IUPAC: 3-imidazo[1,2-b]pyridazin-7-yl-N-methylbenzamide

Names & synonyms

SCHEMBL837898KDZIIHNFLXZTGT-UHFFFAOYSA-NDB-1366723-imidazo[1,2-b]pyridazin-7-yl-N-methylbenzamide3-imidazo-[1,2-b]-pyridazin-7-yl-N-methyl-benzamide1107655-33-3

Database identifiers

PubChem CID: 59443501

Properties

Computed structural properties

XLogP: 1.2
Topological polar surface area: 59.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 2
Heavy atoms: 19
Formal charge: 0
Complexity: 335

Related reactions

3 records

New reaction record

HRID 296266As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

HRID 1097320As productuspto-grants-2012_03

HRID 1097321As reactantuspto-grants-2012_03

Compound notes

Loading…