2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol

C15H12BrNOS — CID 81144222

IUPAC2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
SMILESOC(Cc1ccc(Br)cc1)c1cnc2ccsc2c1
InChIInChI=1S/C15H12BrNOS/c16-12-3-1-10(2-4-12)7-14(18)11-8-15-13(17-9-11)5-6-19-15/h1-6,8-9,14,18H,7H2
InChIKeyLIERWBBPTLKPRI-UHFFFAOYSA-N
MW334.24 g/mol
LogP4.33
Rot. Bonds3

About 2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol

2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol (PubChem CID 81144222) has the molecular formula C15H12BrNOS and a molecular weight of 334.24 g/mol. Its IUPAC name is 2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol.

Molecular Properties

Compound Name2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
PubChem CID81144222
Molecular FormulaC15H12BrNOS
Molecular Weight334.24 g/mol
Exact Mass332.98
IUPAC Name2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
SMILESOC(Cc1ccc(Br)cc1)c1cnc2ccsc2c1
InChIInChI=1S/C15H12BrNOS/c16-12-3-1-10(2-4-12)7-14(18)11-8-15-13(17-9-11)5-6-19-15/h1-6,8-9,14,18H,7H2
InChIKeyLIERWBBPTLKPRI-UHFFFAOYSA-N
XLogP4.33
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.24
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol 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-(5-bromo-2-fluorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
CID 81144033
2-(4-bromophenyl)-N-methyl-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 81143696
1-thieno[3,2-b]pyridin-6-yl-2-thiophen-3-ylethanol
CID 81144126
1-thieno[3,2-b]pyridin-6-ylbut-3-en-1-ol
CID 81144232
2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
CID 81143648
2-(3-chloro-4-pyridinyl)-1-thieno[3,2-b]pyridin-6-ylethanol
CID 81143765
1-thieno[3,2-b]pyridin-6-ylethanol
CID 64830910
2-(4-methylphenyl)-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 81144150
(4-propylphenyl)-thieno[3,2-b]pyridin-6-ylmethanol
CID 81143867
[2-(4-bromothiophen-2-yl)-1-thieno[3,2-b]pyridin-6-ylethyl]hydrazine
CID 105256508
[2-(3-bromo-5-fluorophenyl)-1-thieno[3,2-b]pyridin-6-ylethyl]hydrazine
CID 105256410
2-(4-chlorophenyl)-N-methyl-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 81143973

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol?
The IUPAC name of 2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol (CID 81144222) is 2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol.
What is the SMILES notation for 2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol?
The canonical SMILES for 2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol is OC(Cc1ccc(Br)cc1)c1cnc2ccsc2c1.
What is the InChIKey of 2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol?
The InChIKey is LIERWBBPTLKPRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrNOS/c16-12-3-1-10(2-4-12)7-14(18)11-8-15-13(17-9-11)5-6-19-15/h1-6,8-9,14,18H,7H2.
What are the key properties of 2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol?
2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol has a molecular weight of 334.24 g/mol, XLogP of 4.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol is sourced from PubChem (CID 81144222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).