tert-butyl 4-(7-bromo-6-chloroquinazolin-4-yl)piperazine-1-carboxylate(WXC04824)


Chemical Name: tert-butyl 4-(7-bromo-6-chloroquinazolin-4-yl)piperazine-1-carboxylate(WXC04824)
CAS Number: 1698027-00-7
Product Number: AG019EUF(AG019EUF)
Synonyms:
MDL No:
Molecular Formula: C17H20BrClN4O2
Molecular Weight: 427.7233

Identification/Properties


Computed Properties
Molecular Weight:
427.727g/mol
XLogP3:
4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
426.046g/mol
Monoisotopic Mass:
426.046g/mol
Topological Polar Surface Area:
58.6A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
482
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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