4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride

C19H22ClN3 — CID 23723094

IUPAC4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride
SMILESCCCCN1C2=NC(c3ccccc3)CN2c2ccccc21.Cl
InChIInChI=1S/C19H21N3.ClH/c1-2-3-13-21-17-11-7-8-12-18(17)22-14-16(20-19(21)22)15-9-5-4-6-10-15;/h4-12,16H,2-3,13-14H2,1H3;1H
InChIKeySUYRRINMRXLOSZ-UHFFFAOYSA-N
MW327.86 g/mol
LogP4.65
Rot. Bonds4

About 4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride

4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride (PubChem CID 23723094) has the molecular formula C19H22ClN3 and a molecular weight of 327.86 g/mol. Its IUPAC name is 4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride.

Molecular Properties

Compound Name4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride
PubChem CID23723094
Molecular FormulaC19H22ClN3
Molecular Weight327.86 g/mol
Exact Mass327.15
IUPAC Name4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride
SMILESCCCCN1C2=NC(c3ccccc3)CN2c2ccccc21.Cl
InChIInChI=1S/C19H21N3.ClH/c1-2-3-13-21-17-11-7-8-12-18(17)22-14-16(20-19(21)22)15-9-5-4-6-10-15;/h4-12,16H,2-3,13-14H2,1H3;1H
InChIKeySUYRRINMRXLOSZ-UHFFFAOYSA-N
XLogP4.65
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.86
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride?
The IUPAC name of 4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride (CID 23723094) is 4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride.
What is the SMILES notation for 4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride?
The canonical SMILES for 4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride is CCCCN1C2=NC(c3ccccc3)CN2c2ccccc21.Cl.
What is the InChIKey of 4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride?
The InChIKey is SUYRRINMRXLOSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3.ClH/c1-2-3-13-21-17-11-7-8-12-18(17)22-14-16(20-19(21)22)15-9-5-4-6-10-15;/h4-12,16H,2-3,13-14H2,1H3;1H.
What are the key properties of 4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride?
4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride has a molecular weight of 327.86 g/mol, XLogP of 4.65, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-2-phenyl-1,2-dihydroimidazo[1,2-a]benzimidazole;hydrochloride is sourced from PubChem (CID 23723094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).