2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol

C10H8F2N2OS — CID 105083463

IUPAC2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol
SMILESOC(Cc1ccc(F)cc1F)c1csnn1
InChIInChI=1S/C10H8F2N2OS/c11-7-2-1-6(8(12)4-7)3-10(15)9-5-16-14-13-9/h1-2,4-5,10,15H,3H2
InChIKeyJXKPYHRRIIGAEG-UHFFFAOYSA-N
MW242.25 g/mol
LogP2.09
Rot. Bonds3

About 2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol

2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol (PubChem CID 105083463) has the molecular formula C10H8F2N2OS and a molecular weight of 242.25 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol
PubChem CID105083463
Molecular FormulaC10H8F2N2OS
Molecular Weight242.25 g/mol
Exact Mass242.03
IUPAC Name2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol
SMILESOC(Cc1ccc(F)cc1F)c1csnn1
InChIInChI=1S/C10H8F2N2OS/c11-7-2-1-6(8(12)4-7)3-10(15)9-5-16-14-13-9/h1-2,4-5,10,15H,3H2
InChIKeyJXKPYHRRIIGAEG-UHFFFAOYSA-N
XLogP2.09
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.25
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(4-Fluorophenyl)-1,2,3-thiadiazol-4-yl]methanol
CID 69206022
Phenyl-(5-phenylthiadiazol-4-yl)methanol
CID 13494837
1-(5-Phenylthiadiazol-4-yl)butan-1-ol
CID 13494838
2-(2-Chloro-5-fluorophenyl)-1-(thiadiazol-4-yl)ethanol
CID 102623171
[2-Methyl-4-(trifluoromethyl)phenyl]-(thiadiazol-4-yl)methanol
CID 102759063
2-(3-Chloro-2-fluorophenyl)-1-(thiadiazol-4-yl)ethanol
CID 102867464
2-(3-Chloro-4-fluorophenyl)-1-(thiadiazol-4-yl)ethanol
CID 103043682
2-(5-Chloro-2-fluorophenyl)-1-(thiadiazol-4-yl)ethanol
CID 103053464
2-(4-Fluorophenyl)-1-(4-methylthiadiazol-5-yl)ethanol
CID 105076984
2-(4-Fluorophenyl)-1-(thiadiazol-4-yl)ethanol
CID 105077026
1-(4-Ethylthiadiazol-5-yl)-2-(4-fluorophenyl)ethanol
CID 105077031
1-(4-Tert-butylthiadiazol-5-yl)-2-(4-fluorophenyl)ethanol
CID 105077051

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol?
The IUPAC name of 2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol (CID 105083463) is 2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol.
What is the SMILES notation for 2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol?
The canonical SMILES for 2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol is OC(Cc1ccc(F)cc1F)c1csnn1.
What is the InChIKey of 2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol?
The InChIKey is JXKPYHRRIIGAEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8F2N2OS/c11-7-2-1-6(8(12)4-7)3-10(15)9-5-16-14-13-9/h1-2,4-5,10,15H,3H2.
What are the key properties of 2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol?
2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol has a molecular weight of 242.25 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-1-(thiadiazol-4-yl)ethanol is sourced from PubChem (CID 105083463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).