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210100-58-6 | 3H-Imidazo[4,5-f]quinoxaline, 2-azido-3,4,8-trimethyl-
CAS No: 210100-58-6 Catalog No: AG002KLE MDL No:
Product Description
Catalog Number:
AG002KLE
Chemical Name:
3H-Imidazo[4,5-f]quinoxaline, 2-azido-3,4,8-trimethyl-
CAS Number:
210100-58-6
Molecular Formula:
C12H11N7
Molecular Weight:
253.2626
IUPAC Name:
2-azido-3,4,8-trimethylimidazo[4,5-f]quinoxaline
InChI:
InChI=1S/C12H11N7/c1-6-4-8-9(15-7(2)5-14-8)10-11(6)19(3)12(16-10)17-18-13/h4-5H,1-3H3
InChI Key:
APCQHYAQHVJZMQ-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=Nc1nc2c(n1C)c(C)cc1c2nc(C)cn1
Properties
Complexity:
394
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.108g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.269g/mol
Monoisotopic Mass:
253.108g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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