2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride

C10H9Cl2NO4S — CID 22151120

IUPAC2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride
SMILESO=C1OCCN1Cc1cccc(Cl)c1S(=O)(=O)Cl
InChIInChI=1S/C10H9Cl2NO4S/c11-8-3-1-2-7(9(8)18(12,15)16)6-13-4-5-17-10(13)14/h1-3H,4-6H2
InChIKeyIIUVRGQVXUWPED-UHFFFAOYSA-N
MW310.16 g/mol
LogP2.22
Rot. Bonds3

About 2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride

2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride (PubChem CID 22151120) has the molecular formula C10H9Cl2NO4S and a molecular weight of 310.16 g/mol. Its IUPAC name is 2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride.

Molecular Properties

Compound Name2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride
PubChem CID22151120
Molecular FormulaC10H9Cl2NO4S
Molecular Weight310.16 g/mol
Exact Mass308.96
IUPAC Name2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride
SMILESO=C1OCCN1Cc1cccc(Cl)c1S(=O)(=O)Cl
InChIInChI=1S/C10H9Cl2NO4S/c11-8-3-1-2-7(9(8)18(12,15)16)6-13-4-5-17-10(13)14/h1-3H,4-6H2
InChIKeyIIUVRGQVXUWPED-UHFFFAOYSA-N
XLogP2.22
TPSA63.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.16
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride 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 2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride?
The IUPAC name of 2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride (CID 22151120) is 2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride.
What is the SMILES notation for 2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride?
The canonical SMILES for 2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride is O=C1OCCN1Cc1cccc(Cl)c1S(=O)(=O)Cl.
What is the InChIKey of 2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride?
The InChIKey is IIUVRGQVXUWPED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl2NO4S/c11-8-3-1-2-7(9(8)18(12,15)16)6-13-4-5-17-10(13)14/h1-3H,4-6H2.
What are the key properties of 2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride?
2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride has a molecular weight of 310.16 g/mol, XLogP of 2.22, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-[(2-oxo-1,3-oxazolidin-3-yl)methyl]benzenesulfonyl chloride is sourced from PubChem (CID 22151120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).