N-[4-[(3-bromophenyl)amino]-6-quinazolinyl]-(3-phenyl-2-propynamide)

HCID 9846227
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Basic information

Standard SMILES
O=C(C#Cc1ccccc1)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1
InChIKey
AMDLDOZAZPADNX-UHFFFAOYSA-N
Molecular formula
C23H15BrN4O
Average molar mass
443.3 g/mol

Names & identifiers

Preferred name
N-[4-[(3-bromophenyl)amino]-6-quinazolinyl]-(3-phenyl-2-propynamide)
IUPAC
N-[4-(3-bromoanilino)quinazolin-6-yl]-3-phenylprop-2-ynamide

Names & synonyms

SCHEMBL7208931AMDLDOZAZPADNX-UHFFFAOYSA-NN-[4-[(3-bromophenyl)amino]-6-quinazolinyl]-(3-phenyl-2-propynamide)

Database identifiers

PubChem CID
9846227

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
66.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
29

Related reactions

4 records
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Compound notes

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