2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene

C24H16S2 — CID 173096883

IUPAC2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene
SMILESc1ccc(-c2csc(-c3ccccc3)c2-c2cc3ccccc3s2)cc1
InChIInChI=1S/C24H16S2/c1-3-9-17(10-4-1)20-16-25-24(18-11-5-2-6-12-18)23(20)22-15-19-13-7-8-14-21(19)26-22/h1-16H
InChIKeySJUQGOFJWYEHGQ-UHFFFAOYSA-N
MW368.53 g/mol
LogP7.96
Rot. Bonds3

About 2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene

2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene (PubChem CID 173096883) has the molecular formula C24H16S2 and a molecular weight of 368.53 g/mol. Its IUPAC name is 2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene.

Molecular Properties

Compound Name2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene
PubChem CID173096883
Molecular FormulaC24H16S2
Molecular Weight368.53 g/mol
Exact Mass368.07
IUPAC Name2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene
SMILESc1ccc(-c2csc(-c3ccccc3)c2-c2cc3ccccc3s2)cc1
InChIInChI=1S/C24H16S2/c1-3-9-17(10-4-1)20-16-25-24(18-11-5-2-6-12-18)23(20)22-15-19-13-7-8-14-21(19)26-22/h1-16H
InChIKeySJUQGOFJWYEHGQ-UHFFFAOYSA-N
XLogP7.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500368.53
LogP ≤ 57.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,4-diphenylthiophen-3-yl)-3-phenyl-2-benzothiophene
CID 156552741
2-[13-(1-benzothiophen-2-yl)pentacen-6-yl]-1-benzothiophene
CID 86041165
2,3-bis(1-benzothiophen-2-yl)cycloprop-2-en-1-one
CID 15515264
N-[4-[4-(N-[4-(1-benzothiophen-2-yl)phenyl]anilino)phenyl]phenyl]-4-[4-(N-[4-[4-(N-[4-(1-benzothiophen-2-yl)phenyl]anilino)phenyl]phenyl]anilino)phenyl]-N-phenylaniline;4-N-[4-(1-benzothiophen-2-yl)phenyl]-1-N-[4-[4-(N-[4-(N-[4-(1-benzothiophen-2-yl)phenyl]anilino)phenyl]anilino)phenyl]phenyl]-1-N,4-N-diphenylbenzene-1,4-diamine;N-[4-(1-benzothiophen-3-yl)phenyl]-4-[4-(N-[4-(1-benzothiophen-3-yl)phenyl]anilino)phenyl]-N-phenylaniline;N-[4-(1-benzothiophen-3-yl)phenyl]-N-[4-[4-(N-[4-(1-benzothiophen-3-yl)phenyl]-4-phenylanilino)phenyl]phenyl]-4-phenylaniline
CID 158887917
2-[4-[3,5-bis[4-(1-benzothiophen-2-yl)thiophen-3-yl]phenyl]thiophen-3-yl]-1-benzothiophene
CID 58130437
2-[4-(1-benzothiophen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 146183527
2-[4-phenyl-3-(trifluoromethyl)phenyl]-1-benzothiophene
CID 141101540
2-(1-benzothiophen-2-yl)-4-(3-phenylphenyl)-6-[4-(2,3,4,5-tetraphenylphenyl)phenyl]-1,3,5-triazine
CID 146246095
2-(1-benzothiophen-2-yl)benzene-1,3-diamine
CID 102202625
2-(2,6-dimethylphenyl)-1-benzothiophene
CID 641356
2-(1-benzothiophen-2-yl)-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 146183055
4-(1-benzothiophen-2-yl)-2-(2-phenylphenyl)-6-(4-phenylphenyl)pyrimidine
CID 146183109

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene?
The IUPAC name of 2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene (CID 173096883) is 2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene.
What is the SMILES notation for 2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene?
The canonical SMILES for 2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene is c1ccc(-c2csc(-c3ccccc3)c2-c2cc3ccccc3s2)cc1.
What is the InChIKey of 2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene?
The InChIKey is SJUQGOFJWYEHGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16S2/c1-3-9-17(10-4-1)20-16-25-24(18-11-5-2-6-12-18)23(20)22-15-19-13-7-8-14-21(19)26-22/h1-16H.
What are the key properties of 2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene?
2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene has a molecular weight of 368.53 g/mol, XLogP of 7.96, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-diphenylthiophen-3-yl)-1-benzothiophene is sourced from PubChem (CID 173096883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).