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Home > Imidazoles > 893727-64-5
893727-64-5 | 1-[(1,2-dimethyl-1H-imidazol-4-yl)sulfonyl]piperazine
CAS No: 893727-64-5 Catalog No: AG01A0SE MDL No:MFCD07364373
Product Description
Catalog Number:
AG01A0SE
Chemical Name:
1-[(1,2-dimethyl-1H-imidazol-4-yl)sulfonyl]piperazine
CAS Number:
893727-64-5
Molecular Formula:
C9H16N4O2S
Molecular Weight:
244.3139
MDL Number:
MFCD07364373
IUPAC Name:
1-(1,2-dimethylimidazol-4-yl)sulfonylpiperazine
InChI:
InChI=1S/C9H16N4O2S/c1-8-11-9(7-12(8)2)16(14,15)13-5-3-10-4-6-13/h7,10H,3-6H2,1-2H3
InChI Key:
ZRHCFFKAPVSHBU-UHFFFAOYSA-N
SMILES:
Cn1cc(nc1C)S(=O)(=O)N1CCNCC1
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.099g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.313g/mol
Monoisotopic Mass:
244.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
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