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

C10H6BrFN2O2S — CID 53309399

IUPACN-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide
SMILESO=C(Nc1ncc(Br)s1)c1ccc(F)cc1O
InChIInChI=1S/C10H6BrFN2O2S/c11-8-4-13-10(17-8)14-9(16)6-2-1-5(12)3-7(6)15/h1-4,15H,(H,13,14,16)
InChIKeyOWYODDBXLHQNHU-UHFFFAOYSA-N
MW317.14 g/mol
LogP3.00
Rot. Bonds2

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

N-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide (PubChem CID 53309399) has the molecular formula C10H6BrFN2O2S and a molecular weight of 317.14 g/mol. Its IUPAC name is N-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide
PubChem CID53309399
Molecular FormulaC10H6BrFN2O2S
Molecular Weight317.14 g/mol
Exact Mass315.93
IUPAC NameN-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide
SMILESO=C(Nc1ncc(Br)s1)c1ccc(F)cc1O
InChIInChI=1S/C10H6BrFN2O2S/c11-8-4-13-10(17-8)14-9(16)6-2-1-5(12)3-7(6)15/h1-4,15H,(H,13,14,16)
InChIKeyOWYODDBXLHQNHU-UHFFFAOYSA-N
XLogP3.00
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.14
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 103829649
N-(5-bromo-1,3-thiazol-2-yl)-2-fluorobenzamide
CID 60654750
2-bromo-N-(5-bromo-1,3-thiazol-2-yl)-4-chlorobenzamide
CID 107987897
4-bromo-2-hydroxy-N-(5-methyl-1,3-thiazol-2-yl)benzamide
CID 47435879
N-(5-bromo-1,3-thiazol-2-yl)-2-(trifluoromethyl)benzamide
CID 60654812
6-bromo-N-(5-bromo-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 66462491
N-(5-bromo-1,3-thiazol-2-yl)-3-hydroxybenzamide
CID 60654759
N-(6-bromo-2-pyridinyl)-4-fluoro-2-hydroxybenzamide
CID 103829790
4-fluoro-2-hydroxy-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
CID 103829678
N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]-2-hydroxy-4-methoxybenzamide
CID 55438043
N-(4-amino-2,6-dibromophenyl)-4-fluoro-2-hydroxybenzamide
CID 107013162
N-(5-bromo-1,3-thiazol-2-yl)-2-fluoro-3-methyl-5-nitrobenzamide
CID 103297178

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide?
The IUPAC name of N-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide (CID 53309399) is N-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide.
What is the SMILES notation for N-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide?
The canonical SMILES for N-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide is O=C(Nc1ncc(Br)s1)c1ccc(F)cc1O.
What is the InChIKey of N-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide?
The InChIKey is OWYODDBXLHQNHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6BrFN2O2S/c11-8-4-13-10(17-8)14-9(16)6-2-1-5(12)3-7(6)15/h1-4,15H,(H,13,14,16).
What are the key properties of N-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide?
N-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide has a molecular weight of 317.14 g/mol, XLogP of 3.00, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-1,3-thiazol-2-yl)-4-fluoro-2-hydroxybenzamide is sourced from PubChem (CID 53309399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).