tert-butyl (3R)-4-[6-[(5-chloro-2-methoxy-3-pyridyl)amino]-3-pyridyl]-3-methyl-piperazine-1-carboxylate - ≥97% , CAS No.2227198-90-3

CAS: 2227198-90-3 Cat. No.: T632193 Molecular Weight: 433.93 PubChem CID: 135393344

GRADE & PURITY ≥97%

Synonyms

2227198-90-3 | tert-butyl (3R)-4-{6-[(5-chloro-2-methoxypyridin-3-yl)amino]pyridin-3-yl}-3-methylpiperazine-1-carboxylate | TERT-BUTYL (3R)-4-{6-[(5-CHLORO-2-METHOXYPYRIDIN-3-YL)AMINO]PYRIDIN-3-YL-3-METHYLPIPERAZINE-1-CARBOXYLATE | tert-Butyl (3R)-4-[6-[(

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

2227198-90-3 | tert-butyl (3R)-4-{6-[(5-chloro-2-methoxypyridin-3-yl)amino]pyridin-3-yl}-3-methylpiperazine-1-carboxylate | TERT-BUTYL (3R)-4-{6-[(5-CHLORO-2-METHOXYPYRIDIN-3-YL)AMINO]PYRIDIN-3-YL-3-METHYLPIPERAZINE-1-CARBOXYLATE | tert-Butyl (3R)-4-[6-[(

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Canonical Smiles: CC1CN(CCN1C2=CN=C(C=C2)NC3=C(N=CC(=C3)Cl)OC)C(=O)OC(C)(C)C
• IUPAC Name: tert-butyl (3R)-4-[6-[(5-chloro-2-methoxypyridin-3-yl)amino]pyridin-3-yl]-3-methylpiperazine-1-carboxylate
• InChIKey: KKFMFYGEYZKANS-CQSZACIVSA-N
• INCHI: 1S/C21H28ClN5O3/c1-14-13-26(20(28)30-21(2,3)4)8-9-27(14)16-6-7-18(23-12-16)25-17-10-15(22)11-24-19(17)29-5/h6-7,10-12,14H,8-9,13H2,1-5H3,(H,23,25)/t14-/m1/s1
• PubChem CID: 135393344
• Molecular Weight: 433.93

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Diazinanes
      • Subclass Piperazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Diazinanes
• Subclass: Piperazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridinylpiperazines
• Alternative Parents: N-arylpiperazines Piperazine carboxylic acids Polyhalopyridines Dialkylarylamines Methylpyridines Aminopyridines and derivatives Alkyl aryl ethers 2-halopyridines Imidolactams Heteroaromatic compounds Carbamate esters Trialkylamines Organic carbonic acids and derivatives Vinyl chlorides Secondary amines Propargyl-type 1,3-dipolar organic compounds Enamines Chloroalkenes Carboximidamides Azacyclic compounds Amidines Aldimines Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: N-arylpiperazine - Pyridinylpiperazine - Piperazine-1-carboxylic acid - Polyhalopyridine - Dialkylarylamine - Tertiary aliphatic/aromatic amine - 2-halopyridine - Methylpyridine - Aminopyridine - Alkyl aryl ether - Imidolactam - Pyridine - Heteroaromatic compound - Carbamic acid ester - Tertiary aliphatic amine - Tertiary amine - Carbonic acid derivative - Azacycle - Chloroalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Vinyl halide - Vinyl chloride - Secondary amine - Ether - Enamine - Amidine - Aldimine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Imine - Amine - Aromatic heteromonocyclic 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

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y