3-(4-(cyclopropyl(6-methoxypyridin-3-yl)methoxy)-3-methoxybenzyl)-6-(1-methyl-1H-pyrazol-4-yl)-3H-imidazo[4,5-b]pyridin-2-amine

HCID 118009833

Notes Reactions

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Basic information

Standard SMILES: COc1ccc(C(Oc2ccc(Cn3c(N)nc4cc(-c5cnn(C)c5)cnc43)cc2OC)C2CC2)cn1
InChIKey: YCMJHUJBSMXAEJ-UHFFFAOYSA-N
Molecular formula: C28H29N7O3
Average molar mass: 511.6 g/mol
Monoisotopic mass: 511.23318781

Names & identifiers

Preferred name: 3-(4-(cyclopropyl(6-methoxypyridin-3-yl)methoxy)-3-methoxybenzyl)-6-(1-methyl-1H-pyrazol-4-yl)-3H-imidazo[4,5-b]pyridin-2-amine
IUPAC: 3-[[4-[cyclopropyl-(6-methoxy-3-pyridinyl)methoxy]-3-methoxyphenyl]methyl]-6-(1-methylpyrazol-4-yl)imidazo[4,5-b]pyridin-2-amine

Names & synonyms

CHEMBL3678290SCHEMBL16762971YCMJHUJBSMXAEJ-UHFFFAOYSA-NBDBM164948US9067914, Ex. 3-433-(4-(cyclopropyl(6-methoxypyridin-3-yl)methoxy)-3-methoxybenzyl)-6-(1-methyl-1H-pyrazol-4-yl)-3H-imidazo[4,5-b]pyridin-2-amine

Database identifiers

PubChem CID: 118009833
ChEMBL: CHEMBL3678290

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 115 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 8
Rotatable bonds: 9
Heavy atoms: 38
Formal charge: 0
Complexity: 775

Related reactions

2 records

New reaction record

HRID 706505As productuspto-grants-2015_11

HRID 2178386As productuspto-grants-2015_06

Compound notes

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