2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol

C10H8ClFN2OS — CID 105124053

IUPAC2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol
SMILESOC(Cc1cccc(F)c1Cl)c1cnsn1
InChIInChI=1S/C10H8ClFN2OS/c11-10-6(2-1-3-7(10)12)4-9(15)8-5-13-16-14-8/h1-3,5,9,15H,4H2
InChIKeyXXZRUYGLSVLMFV-UHFFFAOYSA-N
MW258.70 g/mol
LogP2.61
Rot. Bonds3

About 2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol

2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol (PubChem CID 105124053) has the molecular formula C10H8ClFN2OS and a molecular weight of 258.70 g/mol. Its IUPAC name is 2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol.

Molecular Properties

Compound Name2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol
PubChem CID105124053
Molecular FormulaC10H8ClFN2OS
Molecular Weight258.70 g/mol
Exact Mass258.00
IUPAC Name2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol
SMILESOC(Cc1cccc(F)c1Cl)c1cnsn1
InChIInChI=1S/C10H8ClFN2OS/c11-10-6(2-1-3-7(10)12)4-9(15)8-5-13-16-14-8/h1-3,5,9,15H,4H2
InChIKeyXXZRUYGLSVLMFV-UHFFFAOYSA-N
XLogP2.61
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.70
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-chloro-2-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol
CID 102867495
2-(2,6-difluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol
CID 105133056
2-(2-chloro-3-fluorophenyl)-1-(5-fluoro-2-pyridinyl)ethanol
CID 112653500
1-(5-bromo-2-pyridinyl)-2-(2-chloro-3-fluorophenyl)ethanol
CID 113393957
2-(2-chloro-3-fluorophenyl)-1-(2,6-difluorophenyl)ethanol
CID 112653011
2-naphthalen-1-yl-1-(1,2,5-thiadiazol-3-yl)ethanol
CID 105086344
2-(2-chloro-3-fluorophenyl)-1-(4-chlorophenyl)ethanol
CID 112652994
2-(2-chloro-3-fluorophenyl)-1-(3-fluoro-2-pyridinyl)ethanol
CID 112653523
1-(2-aminophenyl)-2-(2-chloro-3-fluorophenyl)ethanol
CID 112653460
1-(3-bromo-2-pyridinyl)-2-(2-chloro-3-fluorophenyl)ethanol
CID 113398316
1-(2-chloro-3-fluorophenyl)-3-(2-chlorophenyl)propan-2-ol
CID 112653439
2-(2-chloro-3-fluorophenyl)-1-(4-methyl-1,3-thiazol-5-yl)ethanol
CID 105124092

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol?
The IUPAC name of 2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol (CID 105124053) is 2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol.
What is the SMILES notation for 2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol?
The canonical SMILES for 2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol is OC(Cc1cccc(F)c1Cl)c1cnsn1.
What is the InChIKey of 2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol?
The InChIKey is XXZRUYGLSVLMFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClFN2OS/c11-10-6(2-1-3-7(10)12)4-9(15)8-5-13-16-14-8/h1-3,5,9,15H,4H2.
What are the key properties of 2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol?
2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol has a molecular weight of 258.70 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-3-fluorophenyl)-1-(1,2,5-thiadiazol-3-yl)ethanol is sourced from PubChem (CID 105124053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).