CAS 939986-11-5

1,1-Dimethylethyl 3-[(6-chloro-3-pyridazinyl)amino]-1-piperidinecarboxylate

Description:

1,1-Dimethylethyl 3-[(6-chloro-3-pyridazinyl)amino]-1-piperidinecarboxylate, identified by its CAS number 939986-11-5, is a chemical compound that features a piperidine ring, which is a six-membered nitrogen-containing heterocycle. This compound is characterized by the presence of a dimethyl group, contributing to its steric bulk, and a chloro-substituted pyridazine moiety, which may influence its biological activity and solubility. The carboxylate functional group suggests potential for interactions with biological targets, making it of interest in medicinal chemistry. The presence of the chloro group can enhance lipophilicity and may affect the compound's pharmacokinetic properties. Overall, this compound's structure indicates potential applications in drug development, particularly in areas requiring modulation of biological pathways. Its specific characteristics, such as solubility, stability, and reactivity, would depend on the surrounding conditions and the presence of other functional groups in the molecular structure.

Formula: C₁₄H₂₁ClN₄O₂

InChI: InChI=1S/C14H21ClN4O2/c1-14(2,3)21-13(20)19-8-4-5-10(9-19)16-12-7-6-11(15)17-18-12/h6-7,10H,4-5,8-9H2,1-3H3,(H,16,18)

InChI key: InChIKey=DFHWCEHEMZTIJI-UHFFFAOYSA-N

SMILES: N(C1CN(C(OC(C)(C)C)=O)CCC1)C2=CC=C(Cl)N=N2

Synonyms:

• 1,1-Dimethylethyl 3-[(6-chloro-3-pyridazinyl)amino]-1-piperidinecarboxylate
• 1-Piperidinecarboxylic acid, 3-[(6-chloro-3-pyridazinyl)amino]-, 1,1-dimethylethyl ester