4-(4-Chloro-quinazolin-6-ylethynyl)-tetrahydro-pyran-4-ol

HCID 15550486
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Basic information

Standard SMILES
OC1(C#Cc2ccc3ncnc(Cl)c3c2)CCOCC1
InChIKey
JDBJUUOYWBLBAZ-UHFFFAOYSA-N
Molecular formula
C15H13ClN2O2
Average molar mass
288.73 g/mol

Names & identifiers

Preferred name
4-(4-Chloro-quinazolin-6-ylethynyl)-tetrahydro-pyran-4-ol
IUPAC
4-[2-(4-chloroquinazolin-6-yl)ethynyl]oxan-4-ol

Names & synonyms

SCHEMBL5548935JDBJUUOYWBLBAZ-UHFFFAOYSA-N4-(4-Chloro-quinazolin-6-ylethynyl)-tetrahydro-pyran-4-ol

Database identifiers

PubChem CID
15550486

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
55.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
20

Related reactions

2 records
New reaction record

Compound notes

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