CAS 890095-72-4

Ethyl 7-amino-4-chloro-2-(methylthio)pyrido[4,3-d]pyrimidine-8-carboxylate

Description:

Ethyl 7-amino-4-chloro-2-(methylthio)pyrido[4,3-d]pyrimidine-8-carboxylate is a chemical compound characterized by its complex heterocyclic structure, which incorporates both pyridine and pyrimidine rings. This compound features an ethyl ester functional group, an amino group, and a chloro substituent, contributing to its potential reactivity and biological activity. The presence of a methylthio group enhances its lipophilicity, which may influence its pharmacokinetic properties. Typically, compounds of this nature are investigated for their potential applications in medicinal chemistry, particularly in the development of pharmaceuticals targeting various biological pathways. The specific arrangement of substituents on the pyrido-pyrimidine framework can significantly affect the compound's interaction with biological targets, making it a subject of interest in drug discovery. Additionally, the compound's CAS number, 890095-72-4, allows for precise identification and retrieval of information in chemical databases, facilitating research and development efforts. Overall, this compound exemplifies the intricate design often found in bioactive molecules.

Formula: C₁₁H₁₁ClN₄O₂S

InChI: InChI=1S/C11H11ClN4O2S/c1-3-18-10(17)6-7-5(4-14-9(6)13)8(12)16-11(15-7)19-2/h4H,3H2,1-2H3,(H2,13,14)

InChI key: InChIKey=PIMRMELXKGAVOM-UHFFFAOYSA-N

SMILES: C(OCC)(=O)C=1C2=C(C(Cl)=NC(SC)=N2)C=NC1N

Synonyms:

• Pyrido[4,3-d]pyrimidine-8-carboxylic acid, 7-amino-4-chloro-2-(methylthio)-, ethyl ester
• Ethyl 7-amino-4-chloro-2-(methylthio)pyrido[4,3-d]pyrimidine-8-carboxylate