Methyl 2-(4-(benzofuran-5-yl)-6-methyl-2-phenylpyrimidin-5-yl)pentanoate

HCID 66955366
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Basic information

Standard SMILES
CCCC(C(=O)OC)c1c(C)nc(-c2ccccc2)nc1-c1ccc2occc2c1
InChIKey
OSVXUYGRBXRUFZ-UHFFFAOYSA-N
Molecular formula
C25H24N2O3
Average molar mass
400.5 g/mol
Monoisotopic mass
400.17869263

Names & identifiers

Preferred name
Methyl 2-(4-(benzofuran-5-yl)-6-methyl-2-phenylpyrimidin-5-yl)pentanoate
IUPAC
methyl 2-[4-(1-benzofuran-5-yl)-6-methyl-2-phenylpyrimidin-5-yl]pentanoate

Names & synonyms

SCHEMBL1226580OSVXUYGRBXRUFZ-UHFFFAOYSA-NMethyl 2-(4-(benzofuran-5-yl)-6-methyl-2-phenylpyrimidin-5-yl)pentanoate

Database identifiers

PubChem CID
66955366

Properties

Computed structural properties

XLogP
5.6
Topological polar surface area
65.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
7
Heavy atoms
30

Related reactions

2 records
New reaction record

Compound notes

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