3-benzyl-1,2-thiazol-4-ol

C10H9NOS — CID 10176483

IUPAC3-benzyl-1,2-thiazol-4-ol
SMILESOc1csnc1Cc1ccccc1
InChIInChI=1S/C10H9NOS/c12-10-7-13-11-9(10)6-8-4-2-1-3-5-8/h1-5,7,12H,6H2
InChIKeyVKKRNNVVUVHJAN-UHFFFAOYSA-N
MW191.25 g/mol
LogP2.44
Rot. Bonds2

About 3-benzyl-1,2-thiazol-4-ol

3-benzyl-1,2-thiazol-4-ol (PubChem CID 10176483) has the molecular formula C10H9NOS and a molecular weight of 191.25 g/mol. Its IUPAC name is 3-benzyl-1,2-thiazol-4-ol.

Molecular Properties

Compound Name3-benzyl-1,2-thiazol-4-ol
PubChem CID10176483
Molecular FormulaC10H9NOS
Molecular Weight191.25 g/mol
Exact Mass191.04
IUPAC Name3-benzyl-1,2-thiazol-4-ol
SMILESOc1csnc1Cc1ccccc1
InChIInChI=1S/C10H9NOS/c12-10-7-13-11-9(10)6-8-4-2-1-3-5-8/h1-5,7,12H,6H2
InChIKeyVKKRNNVVUVHJAN-UHFFFAOYSA-N
XLogP2.44
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.25
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-benzyl-1,2-thiazol-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-benzyl-1,2,5-thiadiazole-3-carboxylic acid
CID 66998022
phenyl(113C)methylbenzene
CID 11194569
bis(benzene-1,4-diol);benzylbenzene
CID 159915102
benzylbenzene;2-[2-(2-hydroxyphenyl)phenyl]phenol
CID 159586840
2-benzyl-6-methoxypyridin-3-ol
CID 1401145
2-benzylfuran-3-ol
CID 54288661
2-benzylphenol;ethane
CID 91068983
lithium;2-benzylphenol;hydride
CID 174706000
2,5-bis(4-benzylphenyl)-[1,3]thiazolo[5,4-d][1,3]thiazole
CID 166805666
CID 131886054
CID 131886054
4-benzyl-2,5-diphenyl-1,3-thiazole
CID 46862429
potassium;benzylbenzene;hydride
CID 173011788

Frequently Asked Questions

What is the IUPAC name of 3-benzyl-1,2-thiazol-4-ol?
The IUPAC name of 3-benzyl-1,2-thiazol-4-ol (CID 10176483) is 3-benzyl-1,2-thiazol-4-ol.
What is the SMILES notation for 3-benzyl-1,2-thiazol-4-ol?
The canonical SMILES for 3-benzyl-1,2-thiazol-4-ol is Oc1csnc1Cc1ccccc1.
What is the InChIKey of 3-benzyl-1,2-thiazol-4-ol?
The InChIKey is VKKRNNVVUVHJAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NOS/c12-10-7-13-11-9(10)6-8-4-2-1-3-5-8/h1-5,7,12H,6H2.
What are the key properties of 3-benzyl-1,2-thiazol-4-ol?
3-benzyl-1,2-thiazol-4-ol has a molecular weight of 191.25 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-1,2-thiazol-4-ol is sourced from PubChem (CID 10176483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).