3-[6-isopropyl-9-(1-methyl-1H-pyrazol-4-yl)-1-oxo-1,2-dihydrobenzo[c]-1,6-naphthyridin-4-yl]prop-2-ynamide

HCID 59375366
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Basic information

Standard SMILES
CC(C)c1nc2c(C#CC(N)=O)c[nH]c(=O)c2c2cc(-c3cnn(C)c3)ccc12
InChIKey
ZWMDNRUKRKPBLX-UHFFFAOYSA-N
Molecular formula
C22H19N5O2
Average molar mass
385.4 g/mol

Names & identifiers

Preferred name
3-[6-isopropyl-9-(1-methyl-1H-pyrazol-4-yl)-1-oxo-1,2-dihydrobenzo[c]-1,6-naphthyridin-4-yl]prop-2-ynamide
IUPAC
3-[9-(1-methylpyrazol-4-yl)-1-oxo-6-propan-2-yl-2H-benzo[c][1,6]naphthyridin-4-yl]prop-2-ynamide

Names & synonyms

SCHEMBL2458930ZWMDNRUKRKPBLX-UHFFFAOYSA-N3-[6-isopropyl-9-(1-methyl-1H-pyrazol-4-yl)-1-oxo-1,2-dihydrobenzo[c]-1,6-naphthyridin-4-yl]prop-2-ynamide

Database identifiers

PubChem CID
59375366

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
103 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
29

Related reactions

2 records
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Compound notes

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