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Home > Imidazoles > 57260-68-1
57260-68-1 | 2-(1-PIPERAZINO)-BENZIMIDAZOLE
CAS No: 57260-68-1 Catalog No: AG00EBE5 MDL No:MFCD16040115
Product Description
Catalog Number:
AG00EBE5
Chemical Name:
2-(1-PIPERAZINO)-BENZIMIDAZOLE
CAS Number:
57260-68-1
Molecular Formula:
C11H14N4
Molecular Weight:
202.2557
MDL Number:
MFCD16040115
IUPAC Name:
2-piperazin-1-yl-1H-benzimidazole
InChI:
InChI=1S/C11H14N4/c1-2-4-10-9(3-1)13-11(14-10)15-7-5-12-6-8-15/h1-4,12H,5-8H2,(H,13,14)
InChI Key:
NZXGDKLTTHIYTB-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)c1nc2c([nH]1)cccc2
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.122g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
202.261g/mol
Monoisotopic Mass:
202.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
Literature
| Title | Journal |
|---|---|
| Functional group interactions of a 5-HT3R antagonist. | BMC biochemistry 20020101 |
| Identification of critical residues in loop E in the 5-HT3ASR binding site. | BMC biochemistry 20020101 |
| 5-HT(3)R binding of lerisetron: an interdisciplinary approach to drug-Receptor interactions. | Bioorganic & medicinal chemistry letters 20010820 |
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