2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide

C11H9Br2N3OS — CID 62799765

IUPAC2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide
SMILESNc1nc(CC(=O)Nc2ccc(Br)cc2Br)cs1
InChIInChI=1S/C11H9Br2N3OS/c12-6-1-2-9(8(13)3-6)16-10(17)4-7-5-18-11(14)15-7/h1-3,5H,4H2,(H2,14,15)(H,16,17)
InChIKeyMCFMALXJAXMSCR-UHFFFAOYSA-N
MW391.09 g/mol
LogP3.43
Rot. Bonds3

About 2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide

2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide (PubChem CID 62799765) has the molecular formula C11H9Br2N3OS and a molecular weight of 391.09 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide
PubChem CID62799765
Molecular FormulaC11H9Br2N3OS
Molecular Weight391.09 g/mol
Exact Mass388.88
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide
SMILESNc1nc(CC(=O)Nc2ccc(Br)cc2Br)cs1
InChIInChI=1S/C11H9Br2N3OS/c12-6-1-2-9(8(13)3-6)16-10(17)4-7-5-18-11(14)15-7/h1-3,5H,4H2,(H2,14,15)(H,16,17)
InChIKeyMCFMALXJAXMSCR-UHFFFAOYSA-N
XLogP3.43
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.09
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-amino-1,3-thiazol-4-yl)-N-(4-bromo-2-methylphenyl)acetamide
CID 62795038
2-(2-amino-1,3-thiazol-4-yl)-N-(2-bromo-5-chloro-4-methylphenyl)acetamide
CID 104723693
N-(2,4-dibromophenyl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide
CID 24663211
N-(2,4-dibromophenyl)-2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]acetamide
CID 24505827
4-[[2-(2-amino-1,3-thiazol-4-yl)acetyl]amino]-3-methylbenzamide
CID 62798358
2-(2-amino-1,3-thiazol-4-yl)-N-(4-fluoro-2-methoxyphenyl)acetamide
CID 62799641
2-(2-amino-1,3-thiazol-4-yl)-N-[3-bromo-2-(methoxymethyl)phenyl]acetamide
CID 62799631
2-(2-amino-1,3-thiazol-4-yl)-N-(2-bromo-4,6-difluorophenyl)acetamide
CID 55119831
2-(2-amino-1,3-thiazol-4-yl)-N-[2-chloro-4-(trifluoromethyl)phenyl]acetamide
CID 62799070
2-(2-anilino-1,3-thiazol-4-yl)-N-(4-bromo-2-methylphenyl)acetamide
CID 30940457
2-(2-amino-1,3-thiazol-4-yl)-N-thiophen-3-ylacetamide
CID 66351961
2-(2-amino-1,3-thiazol-4-yl)-N-pyridin-4-ylacetamide
CID 62795383

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide (CID 62799765) is 2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide is Nc1nc(CC(=O)Nc2ccc(Br)cc2Br)cs1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide?
The InChIKey is MCFMALXJAXMSCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9Br2N3OS/c12-6-1-2-9(8(13)3-6)16-10(17)4-7-5-18-11(14)15-7/h1-3,5H,4H2,(H2,14,15)(H,16,17).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide?
2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide has a molecular weight of 391.09 g/mol, XLogP of 3.43, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)-N-(2,4-dibromophenyl)acetamide is sourced from PubChem (CID 62799765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).