2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol

C12H11Cl2NOS — CID 107124945

IUPAC2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol
SMILESCc1ccc(CC(O)c2ncc(Cl)s2)c(Cl)c1
InChIInChI=1S/C12H11Cl2NOS/c1-7-2-3-8(9(13)4-7)5-10(16)12-15-6-11(14)17-12/h2-4,6,10,16H,5H2,1H3
InChIKeyYKOFHATUGHVJLQ-UHFFFAOYSA-N
MW288.20 g/mol
LogP4.03
Rot. Bonds3

About 2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol

2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol (PubChem CID 107124945) has the molecular formula C12H11Cl2NOS and a molecular weight of 288.20 g/mol. Its IUPAC name is 2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol.

Molecular Properties

Compound Name2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol
PubChem CID107124945
Molecular FormulaC12H11Cl2NOS
Molecular Weight288.20 g/mol
Exact Mass286.99
IUPAC Name2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol
SMILESCc1ccc(CC(O)c2ncc(Cl)s2)c(Cl)c1
InChIInChI=1S/C12H11Cl2NOS/c1-7-2-3-8(9(13)4-7)5-10(16)12-15-6-11(14)17-12/h2-4,6,10,16H,5H2,1H3
InChIKeyYKOFHATUGHVJLQ-UHFFFAOYSA-N
XLogP4.03
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.20
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-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

1,2-bis(2-chloro-4-methylphenyl)ethanol
CID 106868189
2-(2-chloro-4-methylphenyl)-1-pyrazin-2-ylethanol
CID 106867263
2-(2-chloro-4-methylphenyl)-1-(3,4-dichlorophenyl)ethanol
CID 106866180
2-(2-chloro-4-methylphenyl)-1-(2,4,6-trimethylphenyl)ethanol
CID 106866233
1-(5-chloro-1,3-thiazol-2-yl)-2-pyridin-3-ylethanol
CID 107124874
1-(2-aminophenyl)-2-(2-chloro-4-methylphenyl)ethanol
CID 106867344
2-(2-chloro-4-methylphenyl)-1-(1-methylpyrazol-4-yl)ethanol
CID 106866193
2-(2-chloro-4-methylphenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol
CID 106867992
1-(5-chloro-1,3-thiazol-2-yl)-5-methylhexan-1-ol
CID 107124871
1-(5-chloro-1,3-thiazol-2-yl)-2-(3-fluorophenyl)ethanol
CID 107125030
2-(2-chloro-4-methylphenyl)-1-(5-chloro-2-methylphenyl)ethanol
CID 106868133
2-(2-chloro-4-methylphenyl)-1-isoquinolin-4-ylethanol
CID 106866612

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol?
The IUPAC name of 2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol (CID 107124945) is 2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol.
What is the SMILES notation for 2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol?
The canonical SMILES for 2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol is Cc1ccc(CC(O)c2ncc(Cl)s2)c(Cl)c1.
What is the InChIKey of 2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol?
The InChIKey is YKOFHATUGHVJLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11Cl2NOS/c1-7-2-3-8(9(13)4-7)5-10(16)12-15-6-11(14)17-12/h2-4,6,10,16H,5H2,1H3.
What are the key properties of 2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol?
2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol has a molecular weight of 288.20 g/mol, XLogP of 4.03, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-methylphenyl)-1-(5-chloro-1,3-thiazol-2-yl)ethanol is sourced from PubChem (CID 107124945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).