3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene

C24H16S3 — CID 175170754

IUPAC3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene
SMILESc1ccc(-c2ccc(-c3ccsc3-c3ccsc3-c3cccs3)cc2)cc1
InChIInChI=1S/C24H16S3/c1-2-5-17(6-3-1)18-8-10-19(11-9-18)20-12-15-26-23(20)21-13-16-27-24(21)22-7-4-14-25-22/h1-16H
InChIKeyZLEGTVFOZPOHKC-UHFFFAOYSA-N
MW400.59 g/mol
LogP8.54
Rot. Bonds4

About 3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene

3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene (PubChem CID 175170754) has the molecular formula C24H16S3 and a molecular weight of 400.59 g/mol. Its IUPAC name is 3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene.

Molecular Properties

Compound Name3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene
PubChem CID175170754
Molecular FormulaC24H16S3
Molecular Weight400.59 g/mol
Exact Mass400.04
IUPAC Name3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene
SMILESc1ccc(-c2ccc(-c3ccsc3-c3ccsc3-c3cccs3)cc2)cc1
InChIInChI=1S/C24H16S3/c1-2-5-17(6-3-1)18-8-10-19(11-9-18)20-12-15-26-23(20)21-13-16-27-24(21)22-7-4-14-25-22/h1-16H
InChIKeyZLEGTVFOZPOHKC-UHFFFAOYSA-N
XLogP8.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.59
LogP ≤ 58.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene 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

3-phenyl-2-(4-phenylphenyl)thiophene
CID 70178548
3-(4-chlorophenyl)-2-thiophen-2-ylthiophene
CID 172853479
3-phenyl-2-[4-(3-phenylthiophen-2-yl)phenyl]thiophene
CID 67533042
thiophene;2-thiophen-2-yl-3-(3-thiophen-2-ylthiophen-2-yl)thiophene
CID 161377996
3,4-diphenyl-2-thiophen-2-ylthiophene
CID 90930484
3-phenyl-2,5-bis(3-phenylthiophen-2-yl)thiophene
CID 101018673
2-(3,4-diphenylphenyl)thiophene
CID 150825396
3,4-dibromo-2-[2-(2-thiophen-2-ylthiophen-3-yl)thiophen-3-yl]thiophene
CID 68932468
3-phenyl-5-(3-phenylthiophen-2-yl)-2-(4-phenylthiophen-2-yl)thiophene
CID 10695949
2-iodo-3-phenyl-5-(3-phenylthiophen-2-yl)thiophene
CID 139840485
3-[3,5-bis(2-phenylthiophen-3-yl)phenyl]-2-phenylthiophene
CID 58130450
6-phenylcyclopenta[b]thiopyran
CID 175596578

Frequently Asked Questions

What is the IUPAC name of 3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene?
The IUPAC name of 3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene (CID 175170754) is 3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene.
What is the SMILES notation for 3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene?
The canonical SMILES for 3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene is c1ccc(-c2ccc(-c3ccsc3-c3ccsc3-c3cccs3)cc2)cc1.
What is the InChIKey of 3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene?
The InChIKey is ZLEGTVFOZPOHKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16S3/c1-2-5-17(6-3-1)18-8-10-19(11-9-18)20-12-15-26-23(20)21-13-16-27-24(21)22-7-4-14-25-22/h1-16H.
What are the key properties of 3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene?
3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene has a molecular weight of 400.59 g/mol, XLogP of 8.54, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-phenylphenyl)-2-(2-thiophen-2-ylthiophen-3-yl)thiophene is sourced from PubChem (CID 175170754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).