(4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one

C9H7ClFNO2 — CID 130299499

IUPAC(4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one
SMILESO=C1N[C@@H](c2cccc(Cl)c2F)CO1
InChIInChI=1S/C9H7ClFNO2/c10-6-3-1-2-5(8(6)11)7-4-14-9(13)12-7/h1-3,7H,4H2,(H,12,13)/t7-/m1/s1
InChIKeyZPNMJFOJTATOHY-SSDOTTSWSA-N
MW215.61 g/mol
LogP2.26
Rot. Bonds1

About (4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one

(4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one (PubChem CID 130299499) has the molecular formula C9H7ClFNO2 and a molecular weight of 215.61 g/mol. Its IUPAC name is (4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one
PubChem CID130299499
Molecular FormulaC9H7ClFNO2
Molecular Weight215.61 g/mol
Exact Mass215.01
IUPAC Name(4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one
SMILESO=C1N[C@@H](c2cccc(Cl)c2F)CO1
InChIInChI=1S/C9H7ClFNO2/c10-6-3-1-2-5(8(6)11)7-4-14-9(13)12-7/h1-3,7H,4H2,(H,12,13)/t7-/m1/s1
InChIKeyZPNMJFOJTATOHY-SSDOTTSWSA-N
XLogP2.26
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.61
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one 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 (4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one?
The IUPAC name of (4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one (CID 130299499) is (4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for (4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one?
The canonical SMILES for (4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one is O=C1N[C@@H](c2cccc(Cl)c2F)CO1.
What is the InChIKey of (4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one?
The InChIKey is ZPNMJFOJTATOHY-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H7ClFNO2/c10-6-3-1-2-5(8(6)11)7-4-14-9(13)12-7/h1-3,7H,4H2,(H,12,13)/t7-/m1/s1.
What are the key properties of (4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one?
(4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one has a molecular weight of 215.61 g/mol, XLogP of 2.26, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-(3-chloro-2-fluorophenyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 130299499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).