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75380-54-0 | Ethanone,1-(2,4-dimethyl-4H-pyrazolo[1,5-a]benzimidazol-3-yl)-
CAS No: 75380-54-0 Catalog No: AG005M1T MDL No:MFCD01305815
Product Description
Catalog Number:
AG005M1T
Chemical Name:
Ethanone,1-(2,4-dimethyl-4H-pyrazolo[1,5-a]benzimidazol-3-yl)-
CAS Number:
75380-54-0
Molecular Formula:
C13H13N3O
Molecular Weight:
227.2618
MDL Number:
MFCD01305815
IUPAC Name:
1-(2,4-dimethylpyrazolo[1,5-a]benzimidazol-3-yl)ethanone
InChI:
InChI=1S/C13H13N3O/c1-8-12(9(2)17)13-15(3)10-6-4-5-7-11(10)16(13)14-8/h4-7H,1-3H3
InChI Key:
HXUOBVIVDMTQLB-UHFFFAOYSA-N
SMILES:
Cn1c2c(C(=O)C)c(nn2c2c1cccc2)C
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.106g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.267g/mol
Monoisotopic Mass:
227.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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