(4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol

C9H9BrFNO4S — CID 112737087

IUPAC(4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol
SMILESO=S(=O)(c1ccc(Br)c(F)c1)N1C[C@@H](O)CO1
InChIInChI=1S/C9H9BrFNO4S/c10-8-2-1-7(3-9(8)11)17(14,15)12-4-6(13)5-16-12/h1-3,6,13H,4-5H2/t6-/m1/s1
InChIKeyBPMQVKRTQCXZSP-ZCFIWIBFSA-N
MW326.14 g/mol
LogP0.88
Rot. Bonds2

About (4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol

(4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol (PubChem CID 112737087) has the molecular formula C9H9BrFNO4S and a molecular weight of 326.14 g/mol. Its IUPAC name is (4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol.

Molecular Properties

Compound Name(4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol
PubChem CID112737087
Molecular FormulaC9H9BrFNO4S
Molecular Weight326.14 g/mol
Exact Mass324.94
IUPAC Name(4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol
SMILESO=S(=O)(c1ccc(Br)c(F)c1)N1C[C@@H](O)CO1
InChIInChI=1S/C9H9BrFNO4S/c10-8-2-1-7(3-9(8)11)17(14,15)12-4-6(13)5-16-12/h1-3,6,13H,4-5H2/t6-/m1/s1
InChIKeyBPMQVKRTQCXZSP-ZCFIWIBFSA-N
XLogP0.88
TPSA66.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.14
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol?
The IUPAC name of (4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol (CID 112737087) is (4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol.
What is the SMILES notation for (4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol?
The canonical SMILES for (4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol is O=S(=O)(c1ccc(Br)c(F)c1)N1C[C@@H](O)CO1.
What is the InChIKey of (4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol?
The InChIKey is BPMQVKRTQCXZSP-ZCFIWIBFSA-N. The full InChI is InChI=1S/C9H9BrFNO4S/c10-8-2-1-7(3-9(8)11)17(14,15)12-4-6(13)5-16-12/h1-3,6,13H,4-5H2/t6-/m1/s1.
What are the key properties of (4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol?
(4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol has a molecular weight of 326.14 g/mol, XLogP of 0.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-(4-bromo-3-fluorophenyl)sulfonyl-1,2-oxazolidin-4-ol is sourced from PubChem (CID 112737087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).