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6-Bromo-2-[5-bromo-2-[(3-methylpiperidin-1-yl)diazenyl]phenyl]quinazolin-4-amine

HCID 315142
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Basic information

CAS
62888-11-3
Standard SMILES
CC1CCCN(N=Nc2ccc(Br)cc2-c2nc(N)c3cc(Br)ccc3n2)C1
InChIKey
XESZMXUGOFDXFO-UHFFFAOYSA-N
Molecular formula
C20H20Br2N6
Average molar mass
504.2 g/mol
Monoisotopic mass
502.01162

Names & identifiers

Preferred name
6-Bromo-2-[5-bromo-2-[(3-methylpiperidin-1-yl)diazenyl]phenyl]quinazolin-4-amine
IUPAC
6-bromo-2-[5-bromo-2-[(3-methylpiperidin-1-yl)diazenyl]phenyl]quinazolin-4-amine

Names & synonyms

62888-11-3NSC2382046-bromo-2-[5-bromo-2-[(3-methylpiperidin-1-yl)diazenyl]phenyl]quinazolin-4-amineDTXSID50311133NSC-2382046-Bromo-2-{5-bromo-2-[(E)-(3-methylpiperidin-1-yl)diazenyl]phenyl}quinazolin-4-amine

Database identifiers

CAS
62888-11-3
PubChem CID
315142
DTXSID
DTXSID50311133

Properties

Computed structural properties

XLogP
6.2
Topological polar surface area
79.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
28
Formal charge
0
Complexity
549

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Compound notes

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