2-phenyl-1-benzothiophen-4-ol

C14H10OS — CID 154289453

IUPAC2-phenyl-1-benzothiophen-4-ol
SMILESOc1cccc2sc(-c3ccccc3)cc12
InChIInChI=1S/C14H10OS/c15-12-7-4-8-13-11(12)9-14(16-13)10-5-2-1-3-6-10/h1-9,15H
InChIKeyOTPSYTRTTMSGRO-UHFFFAOYSA-N
MW226.30 g/mol
LogP4.27
Rot. Bonds1

About 2-phenyl-1-benzothiophen-4-ol

2-phenyl-1-benzothiophen-4-ol (PubChem CID 154289453) has the molecular formula C14H10OS and a molecular weight of 226.30 g/mol. Its IUPAC name is 2-phenyl-1-benzothiophen-4-ol.

Molecular Properties

Compound Name2-phenyl-1-benzothiophen-4-ol
PubChem CID154289453
Molecular FormulaC14H10OS
Molecular Weight226.30 g/mol
Exact Mass226.05
IUPAC Name2-phenyl-1-benzothiophen-4-ol
SMILESOc1cccc2sc(-c3ccccc3)cc12
InChIInChI=1S/C14H10OS/c15-12-7-4-8-13-11(12)9-14(16-13)10-5-2-1-3-6-10/h1-9,15H
InChIKeyOTPSYTRTTMSGRO-UHFFFAOYSA-N
XLogP4.27
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-phenyl-1-benzothiophen-4-ol 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

4-hydroxy-1-benzothiophene-2-carboxylic acid
CID 84665318
2-phenyl-1-benzothiophen-6-ol
CID 11117751
2-(fluoromethyl)-1-benzothiophen-4-ol
CID 84658438
2-(4-thieno[2,3-b][1]benzothiol-2-ylphenyl)thieno[2,3-b][1]benzothiole
CID 102139033
2-(2-hydroxypropan-2-yl)-1-benzothiophen-4-ol
CID 117120063
6-phenyl-16-[4-(4-phenylphenyl)phenyl]-7,11,15-trithiapentacyclo[10.7.0.02,10.04,8.014,18]nonadeca-1(12),2(10),3,5,8,13,16,18-octaene
CID 164729633
2-[4-(1-benzothiophen-2-yl)phenyl]-4,6-diphenyl-1,3,5-triazine
CID 146183527
6,16-bis[4-(4-phenylphenyl)phenyl]-5,11,17-trithiapentacyclo[10.7.0.02,10.04,8.014,18]nonadeca-1(12),2(10),3,6,8,13,15,18-octaene
CID 164729603
2-(1,1-difluoroethyl)-1-benzothiophen-4-ol
CID 84680280
2-phenyl-3-(2-phenyl-1-benzothiophen-3-yl)-1-benzothiophene
CID 15625929
3-[3-(4-hydroxyphenyl)-1-benzothiophen-2-yl]phenol
CID 91970624
methoxymethane;4-methyl-2-phenylthieno[2,3-c]pyridine
CID 91395588

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-benzothiophen-4-ol?
The IUPAC name of 2-phenyl-1-benzothiophen-4-ol (CID 154289453) is 2-phenyl-1-benzothiophen-4-ol.
What is the SMILES notation for 2-phenyl-1-benzothiophen-4-ol?
The canonical SMILES for 2-phenyl-1-benzothiophen-4-ol is Oc1cccc2sc(-c3ccccc3)cc12.
What is the InChIKey of 2-phenyl-1-benzothiophen-4-ol?
The InChIKey is OTPSYTRTTMSGRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10OS/c15-12-7-4-8-13-11(12)9-14(16-13)10-5-2-1-3-6-10/h1-9,15H.
What are the key properties of 2-phenyl-1-benzothiophen-4-ol?
2-phenyl-1-benzothiophen-4-ol has a molecular weight of 226.30 g/mol, XLogP of 4.27, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-benzothiophen-4-ol is sourced from PubChem (CID 154289453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).