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2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)-4-((4,5-dihydro-1H-imidazol-2-ylamino)methyl)benzamide

HCID 58614923
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(Nc1ccc(Cl)c(-c2ccccn2)c1)c1ccc(CNC2=NCCN2)cc1Cl
InChIKey
NUNXFLADDRFYCD-UHFFFAOYSA-N
Molecular formula
C22H19Cl2N5O
Average molar mass
440.3 g/mol

Names & identifiers

Preferred name
2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)-4-((4,5-dihydro-1H-imidazol-2-ylamino)methyl)benzamide
IUPAC
2-chloro-N-(4-chloro-3-pyridin-2-ylphenyl)-4-[(4,5-dihydro-1H-imidazol-2-ylamino)methyl]benzamide

Names & synonyms

SCHEMBL1071161NUNXFLADDRFYCD-UHFFFAOYSA-N2-chloro-N-(4-chloro-3-(pyridin-2-yl)phenyl)-4-((4,5-dihydro-1H-imidazol-2-ylamino)methyl)benzamide

Database identifiers

PubChem CID
58614923

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
78.4 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
30
Formal charge
0
Complexity
618

Related reactions

4 records
New reaction record
HRID 177180 reaction equation
HRID 177180As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 633148 reaction equation
HRID 633148As productuspto-grants-2016_04
HRID 922997 reaction equation
HRID 922997As productuspto-grants-2016_03
HRID 1364774 reaction equation
HRID 1364774As productuspto-grants-2011_02

Compound notes

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