2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol

C10H8ClFN2OS — CID 105081264

IUPAC2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol
SMILESOC(Cc1c(F)cccc1Cl)c1cnns1
InChIInChI=1S/C10H8ClFN2OS/c11-7-2-1-3-8(12)6(7)4-9(15)10-5-13-14-16-10/h1-3,5,9,15H,4H2
InChIKeyPVRVEULGQZGNPX-UHFFFAOYSA-N
MW258.70 g/mol
LogP2.61
Rot. Bonds3

About 2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol

2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol (PubChem CID 105081264) has the molecular formula C10H8ClFN2OS and a molecular weight of 258.70 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol
PubChem CID105081264
Molecular FormulaC10H8ClFN2OS
Molecular Weight258.70 g/mol
Exact Mass258.00
IUPAC Name2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol
SMILESOC(Cc1c(F)cccc1Cl)c1cnns1
InChIInChI=1S/C10H8ClFN2OS/c11-7-2-1-3-8(12)6(7)4-9(15)10-5-13-14-16-10/h1-3,5,9,15H,4H2
InChIKeyPVRVEULGQZGNPX-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-(2-Chloro-5-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethanol
CID 102623087
2-(2-Chloro-5-fluorophenyl)-1-(4-propan-2-ylthiadiazol-5-yl)ethanol
CID 102623131
2-(2-Chloro-5-fluorophenyl)-1-(thiadiazol-5-yl)ethanol
CID 102623196
2-(2-Chloro-5-fluorophenyl)-1-(4-propylthiadiazol-5-yl)ethanol
CID 102623197
2-(3-Chloro-2-fluorophenyl)-1-(thiadiazol-5-yl)ethanol
CID 102867557
2-(3-Chloro-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol
CID 103043677
2-(5-Chloro-2-fluorophenyl)-1-(thiadiazol-5-yl)ethanol
CID 103053462
2-(4-Fluorophenyl)-1-(thiadiazol-5-yl)ethanol
CID 105077044
(4-Fluorophenyl)-(thiadiazol-5-yl)methanol
CID 105077279
2-(2-Fluorophenyl)-1-(thiadiazol-5-yl)ethanol
CID 105077740
(3-Fluorophenyl)-(thiadiazol-5-yl)methanol
CID 105078376
2-(3-Fluorophenyl)-1-(thiadiazol-5-yl)ethanol
CID 105079052

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol (CID 105081264) is 2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol is OC(Cc1c(F)cccc1Cl)c1cnns1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol?
The InChIKey is PVRVEULGQZGNPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClFN2OS/c11-7-2-1-3-8(12)6(7)4-9(15)10-5-13-14-16-10/h1-3,5,9,15H,4H2.
What are the key properties of 2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol?
2-(2-chloro-6-fluorophenyl)-1-(thiadiazol-5-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-6-fluorophenyl)-1-(thiadiazol-5-yl)ethanol is sourced from PubChem (CID 105081264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).