8-(2,6-Dimethyl-phenyl)-quinoxaline-5-carboxylic acid [5-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amide

HCID 44516607
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Basic information

Standard SMILES
Cc1cccc(C)c1-c1ccc(C(=O)Nc2ccc(CN3CCN(C)CC3)cn2)c2nccnc12
InChIKey
MRVBIUXKNGWBEX-UHFFFAOYSA-N
Molecular formula
C28H30N6O
Average molar mass
466.6 g/mol
Monoisotopic mass
466.2481096

Names & identifiers

Preferred name
8-(2,6-Dimethyl-phenyl)-quinoxaline-5-carboxylic acid [5-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amide
IUPAC
8-(2,6-dimethylphenyl)-N-[5-[(4-methylpiperazin-1-yl)methyl]-2-pyridinyl]quinoxaline-5-carboxamide

Names & synonyms

SCHEMBL12678318MRVBIUXKNGWBEX-UHFFFAOYSA-N8-(2,6-Dimethyl-phenyl)-quinoxaline-5-carboxylic acid [5-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amide

Database identifiers

PubChem CID
44516607

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
74.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
35

Related reactions

1 records
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Compound notes

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