(4-Methyl-tetrahydro-pyran-4-yl)-[2-(3,4,5-trimethoxy-phenyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]-methanone

HCID 44206707
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Basic information

Standard SMILES
COc1cc(-c2cnc3[nH]cc(C(=O)C4(C)CCOCC4)c3n2)cc(OC)c1OC
InChIKey
YCHMHQQKAJCPEY-UHFFFAOYSA-N
Molecular formula
C22H25N3O5
Average molar mass
411.5 g/mol
Monoisotopic mass
411.17942091

Names & identifiers

Preferred name
(4-Methyl-tetrahydro-pyran-4-yl)-[2-(3,4,5-trimethoxy-phenyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]-methanone
IUPAC
(4-methyloxan-4-yl)-[2-(3,4,5-trimethoxyphenyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]methanone

Names & synonyms

SCHEMBL2279369YCHMHQQKAJCPEY-UHFFFAOYSA-N(4-Methyl-tetrahydro-pyran-4-yl)-[2-(3,4,5-trimethoxy-phenyl)-5H-pyrrolo[2,3-b]pyrazin-7-yl]-methanone

Database identifiers

PubChem CID
44206707

Properties

Computed structural properties

XLogP
2.3
Topological polar surface area
95.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
30

Related reactions

1 records
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Compound notes

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