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Home > Imidazoles > 1185319-78-1
1185319-78-1 | 1-Methyl-2-piperazin-1-yl-1H-benzoiMidazole hydrochloride, 98+% C12H17ClN4, MW
CAS No: 1185319-78-1 Catalog No: AG008ZPN MDL No:MFCD10698915
Product Description
Catalog Number:
AG008ZPN
Chemical Name:
1-Methyl-2-piperazin-1-yl-1H-benzoiMidazole hydrochloride, 98+% C12H17ClN4, MW
CAS Number:
1185319-78-1
Molecular Formula:
C12H17ClN4
Molecular Weight:
252.7432
MDL Number:
MFCD10698915
IUPAC Name:
1-methyl-2-piperazin-1-ylbenzimidazole;hydrochloride
InChI:
InChI=1S/C12H16N4.ClH/c1-15-11-5-3-2-4-10(11)14-12(15)16-8-6-13-7-9-16;/h2-5,13H,6-9H2,1H3;1H
InChI Key:
CGQYXYMCQYXFQA-UHFFFAOYSA-N
SMILES:
Cn1c(nc2c1cccc2)N1CCNCC1.Cl
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.114g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
252.746g/mol
Monoisotopic Mass:
252.114g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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