1-benzofuran-2-yl(thiadiazol-4-yl)methanol

C11H8N2O2S — CID 105128865

IUPAC1-benzofuran-2-yl(thiadiazol-4-yl)methanol
SMILESOC(c1csnn1)c1cc2ccccc2o1
InChIInChI=1S/C11H8N2O2S/c14-11(8-6-16-13-12-8)10-5-7-3-1-2-4-9(7)15-10/h1-6,11,14H
InChIKeyOOTZOUCJGGIABM-UHFFFAOYSA-N
MW232.26 g/mol
LogP2.37
Rot. Bonds2

About 1-benzofuran-2-yl(thiadiazol-4-yl)methanol

1-benzofuran-2-yl(thiadiazol-4-yl)methanol (PubChem CID 105128865) has the molecular formula C11H8N2O2S and a molecular weight of 232.26 g/mol. Its IUPAC name is 1-benzofuran-2-yl(thiadiazol-4-yl)methanol.

Molecular Properties

Compound Name1-benzofuran-2-yl(thiadiazol-4-yl)methanol
PubChem CID105128865
Molecular FormulaC11H8N2O2S
Molecular Weight232.26 g/mol
Exact Mass232.03
IUPAC Name1-benzofuran-2-yl(thiadiazol-4-yl)methanol
SMILESOC(c1csnn1)c1cc2ccccc2o1
InChIInChI=1S/C11H8N2O2S/c14-11(8-6-16-13-12-8)10-5-7-3-1-2-4-9(7)15-10/h1-6,11,14H
InChIKeyOOTZOUCJGGIABM-UHFFFAOYSA-N
XLogP2.37
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.26
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-benzofuran-2-yl(thiadiazol-4-yl)methanol 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

1-benzofuran-2-yl(thiadiazol-4-yl)methanamine
CID 105184762
1-benzofuran-2-yl-(5-bromothiophen-3-yl)methanol
CID 105128806
1-benzofuran-2-yl(thiophen-2-yl)methanol
CID 63090596
1-benzofuran-2-yl(imidazo[1,2-a]pyridin-2-yl)methanol
CID 114724050
1-benzofuran-2-yl-(3,6-dimethylpyridazin-4-yl)methanol
CID 105128840
1-benzofuran-2-yl-(4-bromo-2,6-difluorophenyl)methanol
CID 115836064
1-(1-benzofuran-2-yl)-3-chloropropane-1,2-diol
CID 171863453
1-benzofuran-2-yl-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723563
1-benzofuran-2-yl-(3,4-difluorophenyl)methanol
CID 63089375
1-benzofuran-2-yl-(7-fluoro-1-benzofuran-2-yl)methanol
CID 114723565
1-benzofuran-2-yl-(1-methylpyrazol-4-yl)methanol
CID 63090768
1-benzofuran-2-yl-(2-cyclopropylphenyl)methanol
CID 114724251

Frequently Asked Questions

What is the IUPAC name of 1-benzofuran-2-yl(thiadiazol-4-yl)methanol?
The IUPAC name of 1-benzofuran-2-yl(thiadiazol-4-yl)methanol (CID 105128865) is 1-benzofuran-2-yl(thiadiazol-4-yl)methanol.
What is the SMILES notation for 1-benzofuran-2-yl(thiadiazol-4-yl)methanol?
The canonical SMILES for 1-benzofuran-2-yl(thiadiazol-4-yl)methanol is OC(c1csnn1)c1cc2ccccc2o1.
What is the InChIKey of 1-benzofuran-2-yl(thiadiazol-4-yl)methanol?
The InChIKey is OOTZOUCJGGIABM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2O2S/c14-11(8-6-16-13-12-8)10-5-7-3-1-2-4-9(7)15-10/h1-6,11,14H.
What are the key properties of 1-benzofuran-2-yl(thiadiazol-4-yl)methanol?
1-benzofuran-2-yl(thiadiazol-4-yl)methanol has a molecular weight of 232.26 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran-2-yl(thiadiazol-4-yl)methanol is sourced from PubChem (CID 105128865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).