2-[2-(5-bromo-1H-indol-3-yl)ethyl]-3-(3-propan-2-yloxyphenyl)quinazolin-4-one


Chemical Name: 2-[2-(5-bromo-1H-indol-3-yl)ethyl]-3-(3-propan-2-yloxyphenyl)quinazolin-4-one
CAS Number: 133040-77-4
Product Number: AG0011KT(AGN-PC-0L9Q3Z)
Synonyms:
MDL No: MFCD00907856
Molecular Formula: C27H24BrN3O2
Molecular Weight: 502.4024

Identification/Properties


Computed Properties
Molecular Weight:
502.412g/mol
XLogP3:
5.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
501.105g/mol
Monoisotopic Mass:
501.105g/mol
Topological Polar Surface Area:
57.7A^2
Heavy Atom Count:
33
Formal Charge:
0
Complexity:
728
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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