4-(7-Trifluoromethyl-4-quinazolinylamino)benzenesulphonic acid

HCID 21273953
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Basic information

Standard SMILES
O=S(=O)(O)c1ccc(Nc2ncnc3cc(C(F)(F)F)ccc23)cc1
InChIKey
CMOQQKMDGLXIBD-UHFFFAOYSA-N
Molecular formula
C15H10F3N3O3S
Average molar mass
369.3 g/mol

Names & identifiers

Preferred name
4-(7-Trifluoromethyl-4-quinazolinylamino)benzenesulphonic acid
IUPAC
4-[[7-(trifluoromethyl)quinazolin-4-yl]amino]benzenesulfonic acid

Names & synonyms

4-(7-Trifluoromethyl-4-quinazolinylamino)benzenesulphonic acidSCHEMBL10496012

Database identifiers

PubChem CID
21273953

Properties

Computed structural properties

XLogP
3
Topological polar surface area
101 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
3
Heavy atoms
25

Related reactions

4 records
New reaction record

Linked notes

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