4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride

C16H15ClFN3 — CID 16681777

IUPAC4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride
SMILESCl.Fc1ccc(CN2C3=NCCN3c3ccccc32)cc1
InChIInChI=1S/C16H14FN3.ClH/c17-13-7-5-12(6-8-13)11-20-15-4-2-1-3-14(15)19-10-9-18-16(19)20;/h1-8H,9-11H2;1H
InChIKeyLWNJPTQGUZZJQU-UHFFFAOYSA-N
MW303.77 g/mol
LogP3.44
Rot. Bonds2

About 4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride

4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride (PubChem CID 16681777) has the molecular formula C16H15ClFN3 and a molecular weight of 303.77 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride.

Molecular Properties

Compound Name4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride
PubChem CID16681777
Molecular FormulaC16H15ClFN3
Molecular Weight303.77 g/mol
Exact Mass303.09
IUPAC Name4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride
SMILESCl.Fc1ccc(CN2C3=NCCN3c3ccccc32)cc1
InChIInChI=1S/C16H14FN3.ClH/c17-13-7-5-12(6-8-13)11-20-15-4-2-1-3-14(15)19-10-9-18-16(19)20;/h1-8H,9-11H2;1H
InChIKeyLWNJPTQGUZZJQU-UHFFFAOYSA-N
XLogP3.44
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.77
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride?
The IUPAC name of 4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride (CID 16681777) is 4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride.
What is the SMILES notation for 4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride?
The canonical SMILES for 4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride is Cl.Fc1ccc(CN2C3=NCCN3c3ccccc32)cc1.
What is the InChIKey of 4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride?
The InChIKey is LWNJPTQGUZZJQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3.ClH/c17-13-7-5-12(6-8-13)11-20-15-4-2-1-3-14(15)19-10-9-18-16(19)20;/h1-8H,9-11H2;1H.
What are the key properties of 4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride?
4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride has a molecular weight of 303.77 g/mol, XLogP of 3.44, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)methyl]-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride is sourced from PubChem (CID 16681777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).