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Home > Bromides > 1228666-56-5
1228666-56-5 | Pyrido[3,2-d]pyrimidin-4(3H)-one, 7-bromo-2-methyl-
CAS No: 1228666-56-5 Catalog No: AG000JNP MDL No:MFCD16628210
Product Description
Catalog Number:
AG000JNP
Chemical Name:
Pyrido[3,2-d]pyrimidin-4(3H)-one, 7-bromo-2-methyl-
CAS Number:
1228666-56-5
Molecular Formula:
C8H6BrN3O
Molecular Weight:
240.0567
MDL Number:
MFCD16628210
IUPAC Name:
7-bromo-2-methyl-3H-pyrido[3,2-d]pyrimidin-4-one
InChI:
InChI=1S/C8H6BrN3O/c1-4-11-6-2-5(9)3-10-7(6)8(13)12-4/h2-3H,1H3,(H,11,12,13)
InChI Key:
SUAHOXUNIGVBOJ-UHFFFAOYSA-N
SMILES:
Brc1cnc2c(c1)nc([nH]c2=O)C
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.969g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.06g/mol
Monoisotopic Mass:
238.969g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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