N-[5-(2,4-dichlorophenyl)-3,6-dimethylpyrazin-2-yl]isoquinolin-1-amine

HCID 22147487

Basic information

Standard SMILES
Cc1nc(-c2ccc(Cl)cc2Cl)c(C)nc1Nc1nccc2ccccc12
InChIKey
LWDQICNILGRMIZ-UHFFFAOYSA-N
Molecular formula
C21H16Cl2N4
Average molar mass
395.3 g/mol
Monoisotopic mass
394.0752019

Names & identifiers

Preferred name
N-[5-(2,4-dichlorophenyl)-3,6-dimethylpyrazin-2-yl]isoquinolin-1-amine
IUPAC
N-[5-(2,4-dichlorophenyl)-3,6-dimethylpyrazin-2-yl]isoquinolin-1-amine

Names & synonyms

SCHEMBL6099930LWDQICNILGRMIZ-UHFFFAOYSA-NN-[5-(2,4-dichlorophenyl)-3,6-dimethylpyrazin-2-yl]isoquinolin 1-amineN-[5-(2,4-dichlorophenyl)-3,6-dimethylpyrazin-2-yl]isoquinolin-1-amine

Database identifiers

PubChem CID
22147487

Properties

Computed structural properties

XLogP
5.9
Topological polar surface area
50.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
27

Related reactions

3 records

Compound notes

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