5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide

C11H8BrFN2OS — CID 24696228

IUPAC5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1csc(NC(=O)c2cc(Br)ccc2F)n1
InChIInChI=1S/C11H8BrFN2OS/c1-6-5-17-11(14-6)15-10(16)8-4-7(12)2-3-9(8)13/h2-5H,1H3,(H,14,15,16)
InChIKeyRFFGFYCNIZQVPS-UHFFFAOYSA-N
MW315.17 g/mol
LogP3.61
Rot. Bonds2

About 5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide

5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide (PubChem CID 24696228) has the molecular formula C11H8BrFN2OS and a molecular weight of 315.17 g/mol. Its IUPAC name is 5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide.

Molecular Properties

Compound Name5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide
PubChem CID24696228
Molecular FormulaC11H8BrFN2OS
Molecular Weight315.17 g/mol
Exact Mass313.95
IUPAC Name5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide
SMILESCc1csc(NC(=O)c2cc(Br)ccc2F)n1
InChIInChI=1S/C11H8BrFN2OS/c1-6-5-17-11(14-6)15-10(16)8-4-7(12)2-3-9(8)13/h2-5H,1H3,(H,14,15,16)
InChIKeyRFFGFYCNIZQVPS-UHFFFAOYSA-N
XLogP3.61
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.17
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-4-chloro-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 103763238
4-bromo-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 683754
5-amino-2,4-difluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 61090250
4-bromo-N-(4-methyl-1,3-thiazol-2-yl)thiophene-2-carboxamide
CID 110763463
5-bromo-2-fluoro-N-(4-methyl-1,3-oxazol-2-yl)benzamide
CID 115669438
4-bromo-N-(4-methyl-1,3-thiazol-2-yl)thiophene-3-carboxamide
CID 164647541
5-bromo-2-fluoro-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]benzamide
CID 8534184
2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 107358521
4-bromo-2-fluoro-N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]benzamide
CID 78863689
5-chloro-2-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 2679160
2,4-diamino-N-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 61089683
2,5-difluoro-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]benzamide
CID 46667765

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The IUPAC name of 5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide (CID 24696228) is 5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide.
What is the SMILES notation for 5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The canonical SMILES for 5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide is Cc1csc(NC(=O)c2cc(Br)ccc2F)n1.
What is the InChIKey of 5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
The InChIKey is RFFGFYCNIZQVPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrFN2OS/c1-6-5-17-11(14-6)15-10(16)8-4-7(12)2-3-9(8)13/h2-5H,1H3,(H,14,15,16).
What are the key properties of 5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide?
5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide has a molecular weight of 315.17 g/mol, XLogP of 3.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-fluoro-N-(4-methyl-1,3-thiazol-2-yl)benzamide is sourced from PubChem (CID 24696228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).