6-Methoxy-N3-(5-methyl-1H-pyrazol-3-yl)-N1-pyridin-3-yl-isoquinoline-1,3-diamine

HCID 57799492
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Basic information

Standard SMILES
COc1ccc2c(Nc3cccnc3)nc(Nc3cc(C)[nH]n3)cc2c1
InChIKey
FFBVNMLFRBTDOX-UHFFFAOYSA-N
Molecular formula
C19H18N6O
Average molar mass
346.4 g/mol

Names & identifiers

Preferred name
6-Methoxy-N3-(5-methyl-1H-pyrazol-3-yl)-N1-pyridin-3-yl-isoquinoline-1,3-diamine
IUPAC
6-methoxy-3-N-(5-methyl-1H-pyrazol-3-yl)-1-N-pyridin-3-ylisoquinoline-1,3-diamine

Names & synonyms

SCHEMBL3974513FFBVNMLFRBTDOX-UHFFFAOYSA-N6-Methoxy-N3-(5-methyl-1H-pyrazol-3-yl)-N1-pyridin-3-yl-isoquinoline-1,3-diamine

Database identifiers

PubChem CID
57799492

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
87.8 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
26

Related reactions

2 records
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Compound notes

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