Compound Identification
SMILES
OC(=O)C(F)(F)F.CC(C)CC1NC2=C(N(CC3=CC=C(Br)C=C3)C1=O)C(=NC=N2)N1CCN(CC1)C1=CC=CC=N1
InChIKey
InChIKey=LVKDSBKUYDXFLX-UHFFFAOYSA-N
Formula
C28H31BrF3N7O3
Mass
650.501
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Diazinanes
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Subclass
Piperazines
- Level 5 Pyridinylpiperazines
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Subclass
Piperazines
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Class
Diazinanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazinanes
Subclass
Piperazines
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinylpiperazines
Alternative Parents
N-arylpiperazines Alpha amino acids and derivatives Pteridines and derivatives Dialkylarylamines Aminopyridines and derivatives Aminopyrimidines and derivatives Bromobenzenes Aryl bromides Imidolactams Heteroaromatic compounds Alpha-halocarboxylic acids Tertiary carboxylic acid amides Lactams Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Alkyl fluorides Organobromides Organofluorides
Molecular Framework
Not available
Substituents
Pyridinylpiperazine - N-arylpiperazine - Alpha-amino acid or derivatives - Pteridine - Dialkylarylamine - Aminopyridine - Aminopyrimidine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyridine - Imidolactam - Pyrimidine - Benzenoid - Tertiary carboxylic acid amide - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid - Heteroaromatic compound - Lactam - Carboxamide group - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Organic oxide - Organooxygen compound - Organohalogen compound - Organobromide - Organofluoride - Amine - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinylpiperazines. These are compounds containing a pyridinylpiperazine skeleton, which consists of a pyridine linked (not fused) to a piperazine by a bond by a single bond that is not part of a ring.
External Descriptors
Not available