2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan

C34H22OS — CID 143850854

IUPAC2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan
SMILESc1ccc2sc(-c3ccc(-c4ccc(-c5ccc(-c6cccc7ccccc67)cc5)o4)cc3)cc2c1
InChIInChI=1S/C34H22OS/c1-3-9-29-23(6-1)8-5-10-30(29)24-12-14-25(15-13-24)31-20-21-32(35-31)26-16-18-27(19-17-26)34-22-28-7-2-4-11-33(28)36-34/h1-22H
InChIKeyZKJYCLFAPCQLFC-UHFFFAOYSA-N
MW478.62 g/mol
LogP10.32
Rot. Bonds4

About 2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan

2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan (PubChem CID 143850854) has the molecular formula C34H22OS and a molecular weight of 478.62 g/mol. Its IUPAC name is 2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan.

Molecular Properties

Compound Name2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan
PubChem CID143850854
Molecular FormulaC34H22OS
Molecular Weight478.62 g/mol
Exact Mass478.14
IUPAC Name2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan
SMILESc1ccc2sc(-c3ccc(-c4ccc(-c5ccc(-c6cccc7ccccc67)cc5)o4)cc3)cc2c1
InChIInChI=1S/C34H22OS/c1-3-9-29-23(6-1)8-5-10-30(29)24-12-14-25(15-13-24)31-20-21-32(35-31)26-16-18-27(19-17-26)34-22-28-7-2-4-11-33(28)36-34/h1-22H
InChIKeyZKJYCLFAPCQLFC-UHFFFAOYSA-N
XLogP10.32
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.62
LogP ≤ 510.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan 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

2-[4-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]-1-benzothiophene
CID 59866469
2-(4-chlorophenyl)-5-(4-naphthalen-1-ylphenyl)furan
CID 143850881
2-[4-[5-(4-naphthalen-1-ylphenyl)furan-2-yl]phenyl]-1-benzofuran
CID 143851022
2-chrysen-2-yl-1-benzothiophene
CID 58362123
CID 59413459
CID 59413459
2-(6-naphthalen-1-ylbenzo[a]anthracen-4-yl)-1-benzothiophene
CID 59412734
2-[4-(1-benzothiophen-2-yl)phenyl]-4-[4-(10-phenylanthracen-9-yl)phenyl]-6-(2-phenylphenyl)-1,3,5-triazine
CID 146183675
5-[5-[4-(1-benzofuran-2-yl)phenyl]furan-2-yl]-2-(1-benzothiophen-2-yl)phenol;ethane
CID 143851118
4-(5-naphthalen-1-ylfuran-2-yl)pyridine
CID 56932024
2-[4-(1-benzothiophen-2-yl)phenyl]-4-dibenzothiophen-4-yl-6-phenyl-1,3,5-triazine
CID 146183517
2-[4-(1-benzothiophen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 146183527
1-[4-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]naphthalene
CID 10983707

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan?
The IUPAC name of 2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan (CID 143850854) is 2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan.
What is the SMILES notation for 2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan?
The canonical SMILES for 2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan is c1ccc2sc(-c3ccc(-c4ccc(-c5ccc(-c6cccc7ccccc67)cc5)o4)cc3)cc2c1.
What is the InChIKey of 2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan?
The InChIKey is ZKJYCLFAPCQLFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H22OS/c1-3-9-29-23(6-1)8-5-10-30(29)24-12-14-25(15-13-24)31-20-21-32(35-31)26-16-18-27(19-17-26)34-22-28-7-2-4-11-33(28)36-34/h1-22H.
What are the key properties of 2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan?
2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan has a molecular weight of 478.62 g/mol, XLogP of 10.32, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-benzothiophen-2-yl)phenyl]-5-(4-naphthalen-1-ylphenyl)furan is sourced from PubChem (CID 143850854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).