4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol

C17H11NO2S — CID 135687463

IUPAC4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol
SMILESOc1ccc(-c2nc(-c3cc4ccccc4o3)cs2)cc1
InChIInChI=1S/C17H11NO2S/c19-13-7-5-11(6-8-13)17-18-14(10-21-17)16-9-12-3-1-2-4-15(12)20-16/h1-10,19H
InChIKeyQOUIEKYLSNCGNJ-UHFFFAOYSA-N
MW293.35 g/mol
LogP4.93
Rot. Bonds2

About 4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol

4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol (PubChem CID 135687463) has the molecular formula C17H11NO2S and a molecular weight of 293.35 g/mol. Its IUPAC name is 4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol.

Molecular Properties

Compound Name4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol
PubChem CID135687463
Molecular FormulaC17H11NO2S
Molecular Weight293.35 g/mol
Exact Mass293.05
IUPAC Name4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol
SMILESOc1ccc(-c2nc(-c3cc4ccccc4o3)cs2)cc1
InChIInChI=1S/C17H11NO2S/c19-13-7-5-11(6-8-13)17-18-14(10-21-17)16-9-12-3-1-2-4-15(12)20-16/h1-10,19H
InChIKeyQOUIEKYLSNCGNJ-UHFFFAOYSA-N
XLogP4.93
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

FR150011
CID 10159191
4-(1-Benzofuran-2-yl)-1,3-thiazol-2-amine
CID 2303676
4-[4-(1-Benzofuran-2-yl)-1,3-thiazol-2-yl]morpholine
CID 2484138
4-(1-Benzofuran-2-yl)-2-(4-methylpiperazin-1-yl)-1,3-thiazole
CID 2470878
(E)-3-Biphenyl-4-yl-2-(4-furan-2-yl-thiazol-2-yl)-acrylonitrile
CID 5913111
8-[2-(4-Carboxyphenyl)thiazol-4-yl]dibenzo[b,d]furan-4-carboxylic acid
CID 46933149
8-[2-(4-Iodophenyl)thiazol-4-yl]dibenzo[b,d]furan-4-carboxylic acid
CID 46933294
8-[2-(3-Iodophenyl)thiazol-4-yl]dibenzo[b,d]furan-4-carboxylic acid
CID 46933295
8-[2-[4-[(E)-2-carboxyethenyl]phenyl]-1,3-thiazol-4-yl]dibenzofuran-4-carboxylic acid
CID 46933442
8-[2-[3-[(E)-2-carboxyethenyl]phenyl]-1,3-thiazol-4-yl]dibenzofuran-4-carboxylic acid
CID 46933443
1-[4-(1-Benzofuran-2-yl)-1,3-thiazol-2-yl]-1-(3-fluorophenyl)ethanol
CID 46942964
[4-(1-Benzofuran-2-yl)-1,3-thiazol-2-yl]-phenylmethanol
CID 46943021

Frequently Asked Questions

What is the IUPAC name of 4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol?
The IUPAC name of 4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol (CID 135687463) is 4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol.
What is the SMILES notation for 4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol?
The canonical SMILES for 4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol is Oc1ccc(-c2nc(-c3cc4ccccc4o3)cs2)cc1.
What is the InChIKey of 4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol?
The InChIKey is QOUIEKYLSNCGNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11NO2S/c19-13-7-5-11(6-8-13)17-18-14(10-21-17)16-9-12-3-1-2-4-15(12)20-16/h1-10,19H.
What are the key properties of 4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol?
4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol has a molecular weight of 293.35 g/mol, XLogP of 4.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]phenol is sourced from PubChem (CID 135687463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).