1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol

C11H10ClNOS — CID 44603813

IUPAC1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol
SMILESCC(O)c1cc(-c2ccc(Cl)cc2)ns1
InChIInChI=1S/C11H10ClNOS/c1-7(14)11-6-10(13-15-11)8-2-4-9(12)5-3-8/h2-7,14H,1H3
InChIKeyDRYSVSZWCGATAA-UHFFFAOYSA-N
MW239.73 g/mol
LogP3.52
Rot. Bonds2

About 1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol

1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol (PubChem CID 44603813) has the molecular formula C11H10ClNOS and a molecular weight of 239.73 g/mol. Its IUPAC name is 1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol.

Molecular Properties

Compound Name1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol
PubChem CID44603813
Molecular FormulaC11H10ClNOS
Molecular Weight239.73 g/mol
Exact Mass239.02
IUPAC Name1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol
SMILESCC(O)c1cc(-c2ccc(Cl)cc2)ns1
InChIInChI=1S/C11H10ClNOS/c1-7(14)11-6-10(13-15-11)8-2-4-9(12)5-3-8/h2-7,14H,1H3
InChIKeyDRYSVSZWCGATAA-UHFFFAOYSA-N
XLogP3.52
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.73
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol 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

Bis(4-chlorophenyl)-(1,2-thiazol-3-yl)methanol
CID 172447880
(4-Fluorophenyl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 119094110
[3-(4-Trifluoromethyl-phenyl)-isothiazol-5-yl]-methanol
CID 59212200
2-(3-(4-Fluorophenyl)isothiazol-5-yl)propan-2-ol
CID 68328241
(3-(4-Chlorophenyl)-5-(trifluoromethyl)isothiazol-4-yl)methanol
CID 90417615
[3-(2-Chloro-6-fluorophenyl)-5-propan-2-yl-1,2-thiazol-4-yl]methanol
CID 141390051
1-[4-[5-(Trifluoromethyl)-1,2-thiazol-3-yl]phenyl]ethanol
CID 152078970
[(1R)-1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethyl] acetate
CID 44603814
(3-Methyl-1,2-thiazol-5-yl)-phenylmethanol
CID 91620842
(4-Chlorophenyl)-(1,2-thiazol-5-yl)methanol
CID 119087694
(4,5-Dichloroisothiazol-3-yl)(4-methylphenyl)-methanol
CID 129752677
(4,5-Dichloroisothiazol-3-yl)phenylmethanol
CID 129752700

Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol?
The IUPAC name of 1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol (CID 44603813) is 1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol.
What is the SMILES notation for 1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol?
The canonical SMILES for 1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol is CC(O)c1cc(-c2ccc(Cl)cc2)ns1.
What is the InChIKey of 1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol?
The InChIKey is DRYSVSZWCGATAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClNOS/c1-7(14)11-6-10(13-15-11)8-2-4-9(12)5-3-8/h2-7,14H,1H3.
What are the key properties of 1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol?
1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol has a molecular weight of 239.73 g/mol, XLogP of 3.52, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-chlorophenyl)-1,2-thiazol-5-yl]ethanol is sourced from PubChem (CID 44603813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).