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1379323-68-8 | Imidazo[2,1-f][1,2,4]triazin-4(1H)-one, 2-amino-7-bromo-
CAS No: 1379323-68-8 Catalog No: AG00145G MDL No:MFCD16250245
Product Description
Catalog Number:
AG00145G
Chemical Name:
Imidazo[2,1-f][1,2,4]triazin-4(1H)-one, 2-amino-7-bromo-
CAS Number:
1379323-68-8
Molecular Formula:
C5H4BrN5O
Molecular Weight:
230.0222
MDL Number:
MFCD16250245
IUPAC Name:
2-amino-7-bromo-3H-imidazo[2,1-f][1,2,4]triazin-4-one
InChI:
InChI=1S/C5H4BrN5O/c6-2-1-8-3-4(12)9-5(7)10-11(2)3/h1H,(H3,7,9,10,12)
InChI Key:
IIIKKFSKRJMHNR-UHFFFAOYSA-N
SMILES:
Nc1nc(=O)c2n([nH]1)c(Br)cn2
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.96g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
230.025g/mol
Monoisotopic Mass:
228.96g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
85.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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