1-(4-Fluoro-benzyl)-2-piperazin-1-yl-1H-benzoimidazole Dihydrochloride - CAS 1187930-00-2
Catalog: |
BB064640 |
Product Name: |
1-(4-Fluoro-benzyl)-2-piperazin-1-yl-1H-benzoimidazole Dihydrochloride |
CAS: |
1187930-00-2 |
Synonyms: |
1-(4-FLUORO-BENZYL)-2-PIPERAZIN-1-YL-1H-BENZOIMIDAZOLE DIHYDROCHLORIDE; 1-[(4-fluorophenyl)methyl]-2-piperazin-1-ylbenzimidazole; dihydrochloride; 1-(4-fluorobenzyl)-2-(piperazin-1-yl)-1H-benzo[d]imidazole dihydrochloride; 1-(4-FLUORO-BENZYL)-2-PIPERAZIN-1-YL-1H-BENZOIMIDAZOLEDIHYDROCHLORIDE |
IUPAC Name: | 1-[(4-fluorophenyl)methyl]-2-piperazin-1-ylbenzimidazoledihydrochloride |
Molecular Weight: | 310.37 + 2(36.46) |
Molecular Formula: | C18H19N4F·2(HCl) |
Canonical SMILES: | C1CN(CCN1)C2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)F.Cl.Cl |
InChI: | InChI=1S/C18H19FN4.2ClH/c19-15-7-5-14(6-8-15)13-23-17-4-2-1-3-16(17)21-18(23)22-11-9-20-10-12-22/h1-8,20H,9-13H22*1H |
InChI Key: | UDEBHDKIBYFKCT-UHFFFAOYSA-N |
Complexity: | 379 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 3 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 382.1127302 |
Formal Charge: | 0 |
Heavy Atom Count: | 25 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 382.1127302 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 33.1Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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