CAS 1126602-45-6

2-Amino-5-chloro-3,9-dihydro-4H-pyrimido[4,5-b]indol-4-one

Description:

2-Amino-5-chloro-3,9-dihydro-4H-pyrimido[4,5-b]indol-4-one is a heterocyclic compound characterized by its complex bicyclic structure, which incorporates both pyrimidine and indole moieties. This compound features an amino group and a chlorine atom, contributing to its reactivity and potential biological activity. The presence of the chlorine substituent can influence the compound's solubility and interaction with biological targets. The dihydro form indicates that it has a saturated bond within the structure, which may affect its stability and reactivity compared to fully unsaturated analogs. This compound may exhibit various pharmacological properties, making it of interest in medicinal chemistry and drug development. Its unique structural features suggest potential applications in areas such as cancer research or as a scaffold for developing new therapeutic agents. However, specific properties such as melting point, solubility, and spectral data would require experimental determination or literature reference for precise characterization.

Formula: C₁₀H₇ClN₄O

InChI: InChI=1S/C10H7ClN4O/c11-4-2-1-3-5-6(4)7-8(13-5)14-10(12)15-9(7)16/h1-3H,(H4,12,13,14,15,16)

InChI key: InChIKey=BCEATAARWXWOBC-UHFFFAOYSA-N

SMILES: O=C1C=2C=3C(NC2NC(N)=N1)=CC=CC3Cl

Synonyms:

• 4H-Pyrimido[4,5-b]indol-4-one, 2-amino-5-chloro-3,9-dihydro-
• 2-Amino-5-chloro-3,9-dihydro-4H-pyrimido[4,5-b]indol-4-one
• 2-Amino-5-chloro-3H,4H,9H-pyrimido[4,5-b]indol-4-one

2-amino-5-chloro-3h-pyrimido[4,5-b]indol-4(9h)-one

CAS: 1126602-45-6

Versatile small molecule scaffold

Formula: C₁₀H₇ClN₄O

Purity: Min. 95%

Molecular weight: 234.64 g/mol

Ref: 3D-BVB60245