3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine

C33H24N2S — CID 156553108

IUPAC3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine
SMILESC1=CC2=NC(c3sc(-c4ccccc4-c4ccccc4)c4ccccc34)C(c3ccccc3)N2C=C1
InChIInChI=1S/C33H24N2S/c1-3-13-23(14-4-1)25-17-7-8-18-26(25)32-27-19-9-10-20-28(27)33(36-32)30-31(24-15-5-2-6-16-24)35-22-12-11-21-29(35)34-30/h1-22,30-31H
InChIKeyKIDFHDRULVSIIV-UHFFFAOYSA-N
MW480.64 g/mol
LogP8.82
Rot. Bonds4

About 3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine

3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine (PubChem CID 156553108) has the molecular formula C33H24N2S and a molecular weight of 480.64 g/mol. Its IUPAC name is 3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine
PubChem CID156553108
Molecular FormulaC33H24N2S
Molecular Weight480.64 g/mol
Exact Mass480.17
IUPAC Name3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine
SMILESC1=CC2=NC(c3sc(-c4ccccc4-c4ccccc4)c4ccccc34)C(c3ccccc3)N2C=C1
InChIInChI=1S/C33H24N2S/c1-3-13-23(14-4-1)25-17-7-8-18-26(25)32-27-19-9-10-20-28(27)33(36-32)30-31(24-15-5-2-6-16-24)35-22-12-11-21-29(35)34-30/h1-22,30-31H
InChIKeyKIDFHDRULVSIIV-UHFFFAOYSA-N
XLogP8.82
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500480.64
LogP ≤ 58.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-phenylnaphthalen-1-yl)-3-(2-phenylphenyl)-2-benzothiophene
CID 156552708
1-(2-phenylphenyl)-3-(3-phenylphenyl)-2-benzothiophene
CID 156553110
2,4-diphenyl-1-[3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]phenyl]imidazole
CID 156553684
1-[2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]phenyl]dibenzofuran
CID 156553127
4-phenyl-3-(3-phenyl-2-benzothiophen-1-yl)pyridine
CID 156553424
4,5-diphenyl-6-[2-(2-phenylphenyl)dibenzothiophen-1-yl]triazine
CID 166133527
CID 69011285
CID 69011285
9-phenyl-10-[10-[4-(2-phenylphenyl)phenyl]anthracen-9-yl]anthracene
CID 140825339
1-(2,6-diphenylphenyl)-3-triphenylen-1-yl-2-benzothiophene
CID 156553113
1-(2-phenyl-1-benzothiophen-3-yl)-3-(2-phenylphenyl)-2-benzofuran
CID 156552692
1-(4-phenylphenyl)-3-triphenylen-1-yl-2-benzothiophene
CID 156553324
9-(2-phenylphenyl)-10-[10-(2-phenylphenyl)anthracen-9-yl]anthracene
CID 21043381

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine?
The IUPAC name of 3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine (CID 156553108) is 3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine.
What is the SMILES notation for 3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine?
The canonical SMILES for 3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine is C1=CC2=NC(c3sc(-c4ccccc4-c4ccccc4)c4ccccc34)C(c3ccccc3)N2C=C1.
What is the InChIKey of 3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine?
The InChIKey is KIDFHDRULVSIIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H24N2S/c1-3-13-23(14-4-1)25-17-7-8-18-26(25)32-27-19-9-10-20-28(27)33(36-32)30-31(24-15-5-2-6-16-24)35-22-12-11-21-29(35)34-30/h1-22,30-31H.
What are the key properties of 3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine?
3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine has a molecular weight of 480.64 g/mol, XLogP of 8.82, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-2-[3-(2-phenylphenyl)-2-benzothiophen-1-yl]-2,3-dihydroimidazo[1,2-a]pyridine is sourced from PubChem (CID 156553108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).