4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol

C14H10OS2 — CID 42644020

IUPAC4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol
SMILESC=C(c1cccs1)c1ccc(O)c2sccc12
InChIInChI=1S/C14H10OS2/c1-9(13-3-2-7-16-13)10-4-5-12(15)14-11(10)6-8-17-14/h2-8,15H,1H2
InChIKeyKMAXMBNMSLUQMJ-UHFFFAOYSA-N
MW258.37 g/mol
LogP4.73
Rot. Bonds2

About 4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol

4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol (PubChem CID 42644020) has the molecular formula C14H10OS2 and a molecular weight of 258.37 g/mol. Its IUPAC name is 4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol.

Molecular Properties

Compound Name4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol
PubChem CID42644020
Molecular FormulaC14H10OS2
Molecular Weight258.37 g/mol
Exact Mass258.02
IUPAC Name4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol
SMILESC=C(c1cccs1)c1ccc(O)c2sccc12
InChIInChI=1S/C14H10OS2/c1-9(13-3-2-7-16-13)10-4-5-12(15)14-11(10)6-8-17-14/h2-8,15H,1H2
InChIKeyKMAXMBNMSLUQMJ-UHFFFAOYSA-N
XLogP4.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.37
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol?
The IUPAC name of 4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol (CID 42644020) is 4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol.
What is the SMILES notation for 4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol?
The canonical SMILES for 4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol is C=C(c1cccs1)c1ccc(O)c2sccc12.
What is the InChIKey of 4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol?
The InChIKey is KMAXMBNMSLUQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10OS2/c1-9(13-3-2-7-16-13)10-4-5-12(15)14-11(10)6-8-17-14/h2-8,15H,1H2.
What are the key properties of 4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol?
4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol has a molecular weight of 258.37 g/mol, XLogP of 4.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-thiophen-2-ylethenyl)-1-benzothiophen-7-ol is sourced from PubChem (CID 42644020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).