2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide

C10H7BrFN3O2S — CID 29369309

IUPAC2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(COc1ccc(F)cc1Br)Nc1nncs1
InChIInChI=1S/C10H7BrFN3O2S/c11-7-3-6(12)1-2-8(7)17-4-9(16)14-10-15-13-5-18-10/h1-3,5H,4H2,(H,14,15,16)
InChIKeyZDSZMMIRGYXSTA-UHFFFAOYSA-N
MW332.15 g/mol
LogP2.46
Rot. Bonds4

About 2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide

2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 29369309) has the molecular formula C10H7BrFN3O2S and a molecular weight of 332.15 g/mol. Its IUPAC name is 2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide
PubChem CID29369309
Molecular FormulaC10H7BrFN3O2S
Molecular Weight332.15 g/mol
Exact Mass330.94
IUPAC Name2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide
SMILESO=C(COc1ccc(F)cc1Br)Nc1nncs1
InChIInChI=1S/C10H7BrFN3O2S/c11-7-3-6(12)1-2-8(7)17-4-9(16)14-10-15-13-5-18-10/h1-3,5H,4H2,(H,14,15,16)
InChIKeyZDSZMMIRGYXSTA-UHFFFAOYSA-N
XLogP2.46
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.15
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide 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

2-(2-bromo-4-propylphenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 19202954
methyl 2-[[2-(2-bromo-4-fluorophenoxy)acetyl]amino]-1,3-thiazole-5-carboxylate
CID 18103661
2-[[2-(2-bromo-4-fluorophenoxy)acetyl]amino]acetamide
CID 8807860
N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-2-(2-bromo-4-fluorophenoxy)acetamide
CID 39026265
2-(2,3-dimethylphenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 19178770
2-(2-bromo-4-fluorophenoxy)-N-methoxyacetamide
CID 51279328
2-(2-bromo-4-fluorophenoxy)-N-(2,5-dichlorophenyl)acetamide
CID 7899911
2-(2-cyanophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 18292317
2-(2-bromo-4-fluorophenoxy)-N-(3,5-dimethyl-1H-pyrazol-4-yl)acetamide
CID 43397452
2-(2-bromo-4-fluorophenoxy)-N-cyanoacetamide
CID 79194674
dimethyl 5-[[2-(2-bromo-4-fluorophenoxy)acetyl]amino]benzene-1,3-dicarboxylate
CID 2627534
N-(5-amino-2-fluorophenyl)-2-(2-bromo-4-fluorophenoxy)acetamide
CID 29040391

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide (CID 29369309) is 2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide is O=C(COc1ccc(F)cc1Br)Nc1nncs1.
What is the InChIKey of 2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is ZDSZMMIRGYXSTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrFN3O2S/c11-7-3-6(12)1-2-8(7)17-4-9(16)14-10-15-13-5-18-10/h1-3,5H,4H2,(H,14,15,16).
What are the key properties of 2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide?
2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 332.15 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-fluorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 29369309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).