2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine

C26H18N4S — CID 3846234

IUPAC2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine
SMILESc1ccc(-c2nc3ccccn3c2Sc2c(-c3ccccc3)nc3ccccn23)cc1
InChIInChI=1S/C26H18N4S/c1-3-11-19(12-4-1)23-25(29-17-9-7-15-21(29)27-23)31-26-24(20-13-5-2-6-14-20)28-22-16-8-10-18-30(22)26/h1-18H
InChIKeyQMICCMNOPMJDHN-UHFFFAOYSA-N
MW418.53 g/mol
LogP6.47
Rot. Bonds4

About 2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine

2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine (PubChem CID 3846234) has the molecular formula C26H18N4S and a molecular weight of 418.53 g/mol. Its IUPAC name is 2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine
PubChem CID3846234
Molecular FormulaC26H18N4S
Molecular Weight418.53 g/mol
Exact Mass418.13
IUPAC Name2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine
SMILESc1ccc(-c2nc3ccccn3c2Sc2c(-c3ccccc3)nc3ccccn23)cc1
InChIInChI=1S/C26H18N4S/c1-3-11-19(12-4-1)23-25(29-17-9-7-15-21(29)27-23)31-26-24(20-13-5-2-6-14-20)28-22-16-8-10-18-30(22)26/h1-18H
InChIKeyQMICCMNOPMJDHN-UHFFFAOYSA-N
XLogP6.47
TPSA34.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.53
LogP ≤ 56.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

Fazadinium Bromide
CID 6321422
2,6-Diphenylimidazo[1,2-a]pyridine
CID 58880626
3-(Diphenylphosphinothioyl)-2-methyl-1-[(2E)-3-phenyl-2-propen-1-yl]imidazo[1,2-a]pyridiniumbromide
CID 46930969
6-[3-(2,2-Difluoroethyl)-5-(6-methylpyridin-2-yl)imidazol-4-yl]imidazo[1,2-a]pyridine
CID 135233366
E6Clv6G2RR
CID 16750138
3,7-Diphenylimidazo[1,2-a]pyridine
CID 5329339
7-Phenyl-3-(pyridin-4-yl)imidazo[1,2-a]pyridine
CID 5329340
Imidazopyridine 10b
CID 5329341
Imidazopyridine 10e
CID 5329344
Imidazopyridine 10f
CID 5329345
Ikk-IN-3
CID 10215156
2-[3-(Cyclohexylmethyl)-5-Phenyl-Imidazol-4-Yl]-[1,3]thiazolo[4,5-E]pyrimidin-7-Amine
CID 10362983

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine?
The IUPAC name of 2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine (CID 3846234) is 2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine?
The canonical SMILES for 2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine is c1ccc(-c2nc3ccccn3c2Sc2c(-c3ccccc3)nc3ccccn23)cc1.
What is the InChIKey of 2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine?
The InChIKey is QMICCMNOPMJDHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18N4S/c1-3-11-19(12-4-1)23-25(29-17-9-7-15-21(29)27-23)31-26-24(20-13-5-2-6-14-20)28-22-16-8-10-18-30(22)26/h1-18H.
What are the key properties of 2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine?
2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine has a molecular weight of 418.53 g/mol, XLogP of 6.47, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)sulfanylimidazo[1,2-a]pyridine is sourced from PubChem (CID 3846234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).