9-(4-Bromo-2-fluorophenylamino)thiazolo[5,4-f]quinazoline-2-carbonitrile

HCID 71277752
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Basic information

Standard SMILES
N#Cc1nc2ccc3ncnc(Nc4ccc(Br)cc4F)c3c2s1
InChIKey
JSQAEDGOVQRZHZ-UHFFFAOYSA-N
Molecular formula
C16H7BrFN5S
Average molar mass
400.2 g/mol

Names & identifiers

Preferred name
9-(4-Bromo-2-fluorophenylamino)thiazolo[5,4-f]quinazoline-2-carbonitrile
IUPAC
9-(4-bromo-2-fluoroanilino)-[1,3]thiazolo[5,4-f]quinazoline-2-carbonitrile

Names & synonyms

SCHEMBL14733455JSQAEDGOVQRZHZ-UHFFFAOYSA-N9-(4-Bromo-2-fluorophenylamino)thiazolo[5,4-f]quinazoline-2-carbonitrile

Database identifiers

PubChem CID
71277752
Nikkaji
J3.376.989J

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
103 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
2
Heavy atoms
24

Related reactions

1 records
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Compound notes

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