2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide

C11H8BrClN2O2S — CID 833175

IUPAC2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(COc1ccc(Br)cc1Cl)Nc1nccs1
InChIInChI=1S/C11H8BrClN2O2S/c12-7-1-2-9(8(13)5-7)17-6-10(16)15-11-14-3-4-18-11/h1-5H,6H2,(H,14,15,16)
InChIKeyXSEBBOASNOYEPD-UHFFFAOYSA-N
MW347.62 g/mol
LogP3.58
Rot. Bonds4

About 2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide

2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide (PubChem CID 833175) has the molecular formula C11H8BrClN2O2S and a molecular weight of 347.62 g/mol. Its IUPAC name is 2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide
PubChem CID833175
Molecular FormulaC11H8BrClN2O2S
Molecular Weight347.62 g/mol
Exact Mass345.92
IUPAC Name2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide
SMILESO=C(COc1ccc(Br)cc1Cl)Nc1nccs1
InChIInChI=1S/C11H8BrClN2O2S/c12-7-1-2-9(8(13)5-7)17-6-10(16)15-11-14-3-4-18-11/h1-5H,6H2,(H,14,15,16)
InChIKeyXSEBBOASNOYEPD-UHFFFAOYSA-N
XLogP3.58
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.62
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-bromo-2-ethylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 19202117
2-(2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 707255
2-(2-bromo-4-propan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 19202118
2-(4-bromo-2-chlorophenoxy)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)acetamide
CID 92546675
2-(2-bromo-4-butan-2-ylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 17189496
2-(2,5-dimethylphenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 715604
2-(4-bromo-2-chlorophenoxy)-N-(3-methyl-2-pyridinyl)acetamide
CID 17173876
2-(4-bromo-2-chlorophenoxy)-N-(2,6-dimethylphenyl)acetamide
CID 2230439
4-methoxy-3-[2-oxo-2-(1,3-thiazol-2-ylamino)ethoxy]benzoic acid
CID 79737424
2-(2-aminophenoxy)-N-(1,3-thiazol-2-yl)acetamide
CID 16772949
2-(4-bromophenyl)-N-(1,3-thiazol-2-yl)acetamide
CID 669868
2-(4-bromo-2-chlorophenoxy)-N-(5-propan-2-yl-1H-pyrazol-3-yl)acetamide
CID 115593026

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide (CID 833175) is 2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide is O=C(COc1ccc(Br)cc1Cl)Nc1nccs1.
What is the InChIKey of 2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide?
The InChIKey is XSEBBOASNOYEPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrClN2O2S/c12-7-1-2-9(8(13)5-7)17-6-10(16)15-11-14-3-4-18-11/h1-5H,6H2,(H,14,15,16).
What are the key properties of 2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide?
2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide has a molecular weight of 347.62 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-2-chlorophenoxy)-N-(1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 833175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).