2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine

C25H18N2S — CID 164614327

IUPAC2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine
SMILESc1ccc(Sc2c(-c3ccccc3)nc3ccc(-c4ccccc4)cn23)cc1
InChIInChI=1S/C25H18N2S/c1-4-10-19(11-5-1)21-16-17-23-26-24(20-12-6-2-7-13-20)25(27(23)18-21)28-22-14-8-3-9-15-22/h1-18H
InChIKeyIMLVJAARZMYPAV-UHFFFAOYSA-N
MW378.50 g/mol
LogP6.82
Rot. Bonds4

About 2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine

2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine (PubChem CID 164614327) has the molecular formula C25H18N2S and a molecular weight of 378.50 g/mol. Its IUPAC name is 2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine
PubChem CID164614327
Molecular FormulaC25H18N2S
Molecular Weight378.50 g/mol
Exact Mass378.12
IUPAC Name2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine
SMILESc1ccc(Sc2c(-c3ccccc3)nc3ccc(-c4ccccc4)cn23)cc1
InChIInChI=1S/C25H18N2S/c1-4-10-19(11-5-1)21-16-17-23-26-24(20-12-6-2-7-13-20)25(27(23)18-21)28-22-14-8-3-9-15-22/h1-18H
InChIKeyIMLVJAARZMYPAV-UHFFFAOYSA-N
XLogP6.82
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.50
LogP ≤ 56.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine?
The IUPAC name of 2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine (CID 164614327) is 2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine?
The canonical SMILES for 2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine is c1ccc(Sc2c(-c3ccccc3)nc3ccc(-c4ccccc4)cn23)cc1.
What is the InChIKey of 2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine?
The InChIKey is IMLVJAARZMYPAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H18N2S/c1-4-10-19(11-5-1)21-16-17-23-26-24(20-12-6-2-7-13-20)25(27(23)18-21)28-22-14-8-3-9-15-22/h1-18H.
What are the key properties of 2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine?
2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine has a molecular weight of 378.50 g/mol, XLogP of 6.82, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diphenyl-3-phenylsulfanylimidazo[1,2-a]pyridine is sourced from PubChem (CID 164614327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).