2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol

C10H8BrFN2OS — CID 105087930

IUPAC2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol
SMILESOC(Cc1ccc(F)cc1Br)c1cnns1
InChIInChI=1S/C10H8BrFN2OS/c11-8-4-7(12)2-1-6(8)3-9(15)10-5-13-14-16-10/h1-2,4-5,9,15H,3H2
InChIKeyVCCPOGSWZICEEF-UHFFFAOYSA-N
MW303.16 g/mol
LogP2.72
Rot. Bonds3

About 2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol

2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol (PubChem CID 105087930) has the molecular formula C10H8BrFN2OS and a molecular weight of 303.16 g/mol. Its IUPAC name is 2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol.

Molecular Properties

Compound Name2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol
PubChem CID105087930
Molecular FormulaC10H8BrFN2OS
Molecular Weight303.16 g/mol
Exact Mass301.95
IUPAC Name2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol
SMILESOC(Cc1ccc(F)cc1Br)c1cnns1
InChIInChI=1S/C10H8BrFN2OS/c11-8-4-7(12)2-1-6(8)3-9(15)10-5-13-14-16-10/h1-2,4-5,9,15H,3H2
InChIKeyVCCPOGSWZICEEF-UHFFFAOYSA-N
XLogP2.72
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.16
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-chloro-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol
CID 105086943
[2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethyl]hydrazine
CID 105296596
2-(2-bromo-4-fluorophenyl)-1-thiophen-2-ylethanol
CID 62607396
2-(2-bromo-4-fluorophenyl)-1-(4-ethylthiadiazol-5-yl)ethanol
CID 105087909
2-(2-methylphenyl)-1-(thiadiazol-5-yl)ethanol
CID 105078109
2-(2-bromo-4-fluorophenyl)-1-(6,7-dihydro-4H-thieno[3,2-c]thiopyran-2-yl)ethanol
CID 115786936
2-(4-fluoro-2-methylphenyl)-N-methyl-1-(thiadiazol-5-yl)ethanamine
CID 105188368
2-(4-bromothiophen-2-yl)-1-(thiadiazol-5-yl)ethanol
CID 105090603
1-(2-amino-5-fluorophenyl)-2-(2-bromo-4-fluorophenyl)ethanol
CID 82684547
2-(2-bromo-4-fluorophenyl)-1-pyridin-2-ylethanol
CID 62608368
2-(2-bromo-4-fluorophenyl)-1-quinoxalin-2-ylethanol
CID 107357592
2-(2-bromo-4-fluorophenyl)-1-[5-(trifluoromethyl)-2-pyridinyl]ethanol
CID 105087921

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol?
The IUPAC name of 2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol (CID 105087930) is 2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol.
What is the SMILES notation for 2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol?
The canonical SMILES for 2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol is OC(Cc1ccc(F)cc1Br)c1cnns1.
What is the InChIKey of 2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol?
The InChIKey is VCCPOGSWZICEEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrFN2OS/c11-8-4-7(12)2-1-6(8)3-9(15)10-5-13-14-16-10/h1-2,4-5,9,15H,3H2.
What are the key properties of 2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol?
2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol has a molecular weight of 303.16 g/mol, XLogP of 2.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-fluorophenyl)-1-(thiadiazol-5-yl)ethanol is sourced from PubChem (CID 105087930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).