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41740-49-2 | 4-METHYL-4H-IMIDAZO[1,5,4-DE]QUINOXALIN-5(6H)-ONE
CAS No: 41740-49-2 Catalog No: AG0075HX MDL No:
Product Description
Catalog Number:
AG0075HX
Chemical Name:
4-METHYL-4H-IMIDAZO[1,5,4-DE]QUINOXALIN-5(6H)-ONE
CAS Number:
41740-49-2
Molecular Formula:
C10H9N3O
Molecular Weight:
187.1980
IUPAC Name:
11-methyl-1,3,9-triazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraen-10-one
InChI:
InChI=1S/C10H9N3O/c1-6-10(14)12-8-4-2-3-7-9(8)13(6)5-11-7/h2-6H,1H3,(H,12,14)
InChI Key:
VRQSPYXESBSCQW-UHFFFAOYSA-N
SMILES:
O=C1Nc2cccc3c2n(C1C)cn3
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.075g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.202g/mol
Monoisotopic Mass:
187.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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