Compound Identification
SMILES
CN1C=C(C=C(NC2=NC=C(C=C2)N2CCN(CC2)C(=O)OC(C)(C)C)C1=O)C1=C(CO)C(=CC=C1)N1N=CC2=CC(=CC(F)=C2C1=O)C(C)(C)C
InChIKey
InChIKey=HZAJAGQOZQWSPS-UHFFFAOYSA-N
Formula
C39H44FN7O5
Mass
709.823
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Phenylpyridines N-arylpiperazines Phthalazinones Piperazine carboxylic acids Benzyl alcohols Dialkylarylamines Aminopyridines and derivatives Pyridinones Pyridazinones Dihydropyridines Aryl fluorides Imidolactams Vinylogous halides Carbamate esters Heteroaromatic compounds Lactams Secondary amines Azacyclic compounds Carbonyl compounds Organic oxides Organofluorides Primary alcohols Aromatic alcohols Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyridine - N-arylpiperazine - Pyridinylpiperazine - Phthalazinone - Phthalazine - Piperazine-1-carboxylic acid - Benzyl alcohol - Dialkylarylamine - Aminopyridine - Dihydropyridine - Pyridazinone - Pyridinone - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Hydropyridine - Pyridazine - Imidolactam - Pyridine - Benzenoid - Carbamic acid ester - Vinylogous halide - Heteroaromatic compound - Tertiary amine - Lactam - Azacycle - Secondary amine - Primary alcohol - Organofluoride - Organohalogen compound - Organonitrogen compound - Organic oxide - Carbonyl group - Alcohol - Amine - Organic nitrogen compound - Organic oxygen compound - Aromatic alcohol - Organooxygen compound - Hydrocarbon derivative - 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