2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine

C31H21NS — CID 155626281

IUPAC2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine
SMILESc1ccc(-c2cccc(-c3cc4sc(-c5ccccc5)c(-c5ccccc5)c4cn3)c2)cc1
InChIInChI=1S/C31H21NS/c1-4-11-22(12-5-1)25-17-10-18-26(19-25)28-20-29-27(21-32-28)30(23-13-6-2-7-14-23)31(33-29)24-15-8-3-9-16-24/h1-21H
InChIKeyODSXNEQZGXVPEI-UHFFFAOYSA-N
MW439.58 g/mol
LogP8.96
Rot. Bonds4

About 2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine

2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine (PubChem CID 155626281) has the molecular formula C31H21NS and a molecular weight of 439.58 g/mol. Its IUPAC name is 2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine.

Molecular Properties

Compound Name2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine
PubChem CID155626281
Molecular FormulaC31H21NS
Molecular Weight439.58 g/mol
Exact Mass439.14
IUPAC Name2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine
SMILESc1ccc(-c2cccc(-c3cc4sc(-c5ccccc5)c(-c5ccccc5)c4cn3)c2)cc1
InChIInChI=1S/C31H21NS/c1-4-11-22(12-5-1)25-17-10-18-26(19-25)28-20-29-27(21-32-28)30(23-13-6-2-7-14-23)31(33-29)24-15-8-3-9-16-24/h1-21H
InChIKeyODSXNEQZGXVPEI-UHFFFAOYSA-N
XLogP8.96
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500439.58
LogP ≤ 58.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,7-diphenyl-2,6-bis(4-phenylphenyl)thieno[2,3-f][1]benzothiole
CID 126653606
6-[3-[3-[3-[3-(2,3-diphenyl-1-benzothiophen-7-yl)phenyl]-5-phenylphenyl]phenyl]phenyl]-2,3-diphenyl-1-benzothiophene
CID 58898587
6-methyl-2,3-diphenyl-1-benzothiophene
CID 13027057
3-[3-(3-phenanthro[9,10-c]pyridin-3-ylphenyl)phenyl]phenanthro[9,10-c]pyridine
CID 59575267
6-methoxy-2,3-diphenyl-1-benzothiophene
CID 13013583
6-(9,10-diphenylanthracen-2-yl)-2,3-bis(4-methylphenyl)-1-benzothiophene
CID 59012338
2-(3-phenylphenyl)-5-[6-(3-phenylphenyl)-3-pyridinyl]pyridine
CID 59629353
N-[4-[10-[4-(N-(2,3-diphenyl-1-benzothiophen-6-yl)-3-phenylanilino)phenyl]anthracen-9-yl]phenyl]-2,3-diphenyl-N-(3-phenylphenyl)-1-benzothiophen-6-amine;N-[4-[10-[4-(N-(2,3-diphenyl-1-benzothiophen-6-yl)-4-phenylanilino)phenyl]anthracen-9-yl]phenyl]-2,3-diphenyl-N-(4-phenylphenyl)-1-benzothiophen-6-amine;N-[4-[10-[4-(N-(2,3-diphenyl-1-benzothiophen-6-yl)-4-pyridin-4-ylanilino)phenyl]anthracen-9-yl]phenyl]-2,3-diphenyl-N-(4-pyridin-4-ylphenyl)-1-benzothiophen-6-amine
CID 158839674
2-phenyl-3-(2-phenyl-1-benzothiophen-3-yl)-1-benzothiophene
CID 15625929
2-[3,5-di(propan-2-yl)phenyl]-6-(3-phenylphenyl)thieno[3,2-c]pyridine
CID 155626016
2-(3,5-dimethylphenyl)-5-(3-phenylphenyl)thieno[2,3-c]pyridine
CID 155626807
3-(3-triphenylen-2-ylphenyl)phenanthro[9,10-c]pyridine
CID 59575305

Frequently Asked Questions

What is the IUPAC name of 2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine?
The IUPAC name of 2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine (CID 155626281) is 2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine.
What is the SMILES notation for 2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine?
The canonical SMILES for 2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine is c1ccc(-c2cccc(-c3cc4sc(-c5ccccc5)c(-c5ccccc5)c4cn3)c2)cc1.
What is the InChIKey of 2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine?
The InChIKey is ODSXNEQZGXVPEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H21NS/c1-4-11-22(12-5-1)25-17-10-18-26(19-25)28-20-29-27(21-32-28)30(23-13-6-2-7-14-23)31(33-29)24-15-8-3-9-16-24/h1-21H.
What are the key properties of 2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine?
2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine has a molecular weight of 439.58 g/mol, XLogP of 8.96, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diphenyl-6-(3-phenylphenyl)thieno[3,2-c]pyridine is sourced from PubChem (CID 155626281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).