1-[4-[2-(2-Fluoro-6-hydroxyphenyl)-7-methylquinazolin-4-yl]piperazin-1-yl]-2-hydroxy-4-methylpentan-1-one

HCID 136366904
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Basic information

Standard SMILES
Cc1ccc2c(N3CCN(C(=O)C(O)CC(C)C)CC3)nc(-c3c(O)cccc3F)nc2c1
InChIKey
KHZNMVLISKQKEJ-UHFFFAOYSA-N
Molecular formula
C25H29FN4O3
Average molar mass
452.5 g/mol

Names & identifiers

Preferred name
1-[4-[2-(2-Fluoro-6-hydroxyphenyl)-7-methylquinazolin-4-yl]piperazin-1-yl]-2-hydroxy-4-methylpentan-1-one
IUPAC
1-[4-[2-(2-fluoro-6-hydroxyphenyl)-7-methylquinazolin-4-yl]piperazin-1-yl]-2-hydroxy-4-methylpentan-1-one

Names & synonyms

SCHEMBL1623852

Database identifiers

PubChem CID
136366904

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
89.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
33

Related reactions

1 records
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Compound notes

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