3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine

C23H16N2S — CID 138982067

IUPAC3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine
SMILESc1ccc(-c2nc3ccccn3c2Sc2ccc3ccccc3c2)cc1
InChIInChI=1S/C23H16N2S/c1-2-9-18(10-3-1)22-23(25-15-7-6-12-21(25)24-22)26-20-14-13-17-8-4-5-11-19(17)16-20/h1-16H
InChIKeyMASUOIOSKNMTNU-UHFFFAOYSA-N
MW352.46 g/mol
LogP6.31
Rot. Bonds3

About 3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine

3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine (PubChem CID 138982067) has the molecular formula C23H16N2S and a molecular weight of 352.46 g/mol. Its IUPAC name is 3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine
PubChem CID138982067
Molecular FormulaC23H16N2S
Molecular Weight352.46 g/mol
Exact Mass352.10
IUPAC Name3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine
SMILESc1ccc(-c2nc3ccccn3c2Sc2ccc3ccccc3c2)cc1
InChIInChI=1S/C23H16N2S/c1-2-9-18(10-3-1)22-23(25-15-7-6-12-21(25)24-22)26-20-14-13-17-8-4-5-11-19(17)16-20/h1-16H
InChIKeyMASUOIOSKNMTNU-UHFFFAOYSA-N
XLogP6.31
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.46
LogP ≤ 56.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine?
The IUPAC name of 3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine (CID 138982067) is 3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine?
The canonical SMILES for 3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine is c1ccc(-c2nc3ccccn3c2Sc2ccc3ccccc3c2)cc1.
What is the InChIKey of 3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine?
The InChIKey is MASUOIOSKNMTNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16N2S/c1-2-9-18(10-3-1)22-23(25-15-7-6-12-21(25)24-22)26-20-14-13-17-8-4-5-11-19(17)16-20/h1-16H.
What are the key properties of 3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine?
3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine has a molecular weight of 352.46 g/mol, XLogP of 6.31, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-naphthalen-2-ylsulfanyl-2-phenylimidazo[1,2-a]pyridine is sourced from PubChem (CID 138982067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).