2-(4-Fluorophenyl)-1-(2-(1-(S)-phenylethyl)amino-4-primidinyl)-5-aminoimidazo[4,5-b]pyridine

HCID 9845305

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Basic information

Standard SMILES: C[C@H](Nc1nccc(-n2c(-c3ccc(F)cc3)nc3nc(N)ccc32)n1)c1ccccc1
InChIKey: ICHINRNOSJBRCE-HNNXBMFYSA-N
Molecular formula: C24H20FN7
Average molar mass: 425.5 g/mol

Names & identifiers

Preferred name: 2-(4-Fluorophenyl)-1-(2-(1-(S)-phenylethyl)amino-4-primidinyl)-5-aminoimidazo[4,5-b]pyridine
IUPAC: 2-(4-fluorophenyl)-1-[2-[[(1S)-1-phenylethyl]amino]pyrimidin-4-yl]imidazo[4,5-b]pyridin-5-amine

Names & synonyms

SCHEMBL6478433ICHINRNOSJBRCE-HNNXBMFYSA-N2-(4-Fluorophenyl)-1-(2-(1-(S)-phenylethyl)amino-4-primidinyl)-5-aminoimidazo[4,5-b]pyridine2-(4-fluorophenyl)-1-(2-(1-(s)-phenylethyl)amino-4-pyrimidinyl)-5-aminoimidazo[4,5-b]pyridine

Database identifiers

PubChem CID: 9845305

Properties

Computed structural properties

XLogP: 4.6
Topological polar surface area: 94.5 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 7
Rotatable bonds: 5
Heavy atoms: 32
Formal charge: 0
Complexity: 595

Related reactions

1 records

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HRID 396376As productuspto-grants-2003_08

Compound notes

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