[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate

C13H11BrClNO6 — CID 8943058

IUPAC[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate
SMILESO=C(COc1ccc(Br)cc1Cl)OCC(=O)N1CCOC1=O
InChIInChI=1S/C13H11BrClNO6/c14-8-1-2-10(9(15)5-8)21-7-12(18)22-6-11(17)16-3-4-20-13(16)19/h1-2,5H,3-4,6-7H2
InChIKeySUBKSWZMJVNPLP-UHFFFAOYSA-N
MW392.59 g/mol
LogP2.00
Rot. Bonds5

About [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate

[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate (PubChem CID 8943058) has the molecular formula C13H11BrClNO6 and a molecular weight of 392.59 g/mol. Its IUPAC name is [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate.

Molecular Properties

Compound Name[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate
PubChem CID8943058
Molecular FormulaC13H11BrClNO6
Molecular Weight392.59 g/mol
Exact Mass390.95
IUPAC Name[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate
SMILESO=C(COc1ccc(Br)cc1Cl)OCC(=O)N1CCOC1=O
InChIInChI=1S/C13H11BrClNO6/c14-8-1-2-10(9(15)5-8)21-7-12(18)22-6-11(17)16-3-4-20-13(16)19/h1-2,5H,3-4,6-7H2
InChIKeySUBKSWZMJVNPLP-UHFFFAOYSA-N
XLogP2.00
TPSA82.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.59
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate with MolForge

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

Launch Full Analysis

Related Compounds

[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] (E)-3-(5-bromo-2-methoxyphenyl)prop-2-enoate
CID 8881803
[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 3,4-dimethoxybenzoate
CID 8649073
4-[2-(4-bromo-2-chlorophenoxy)acetyl]piperazin-2-one
CID 47006993
[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-[4-(1,3-dithiolan-2-yl)phenoxy]acetate
CID 8949655
[(E)-(16-oxo-oxacyclohexadec-5-ylidene)amino] 2-(4-bromo-2-chlorophenoxy)acetate
CID 25198112
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-(2-chlorophenoxy)acetate
CID 8908985
[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 3,5-dichloro-4-methoxybenzoate
CID 9126378
[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-bromo-5-fluorobenzoate
CID 8987566
4-fluoro-2-[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethoxy]benzoic acid
CID 107014254
1-[2-(4-bromo-2-chlorophenoxy)acetyl]pyrrolidine-3-carboxylic acid
CID 63030929
2-(4-bromo-2-chlorophenoxy)-1-cyclopentylethanone
CID 115648637
(4-bromo-2-tert-butylphenyl) 2-(4-bromo-2-chlorophenoxy)acetate
CID 17074465

Frequently Asked Questions

What is the IUPAC name of [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate?
The IUPAC name of [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate (CID 8943058) is [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate.
What is the SMILES notation for [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate?
The canonical SMILES for [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate is O=C(COc1ccc(Br)cc1Cl)OCC(=O)N1CCOC1=O.
What is the InChIKey of [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate?
The InChIKey is SUBKSWZMJVNPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11BrClNO6/c14-8-1-2-10(9(15)5-8)21-7-12(18)22-6-11(17)16-3-4-20-13(16)19/h1-2,5H,3-4,6-7H2.
What are the key properties of [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate?
[2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate has a molecular weight of 392.59 g/mol, XLogP of 2.00, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-oxo-2-(2-oxo-1,3-oxazolidin-3-yl)ethyl] 2-(4-bromo-2-chlorophenoxy)acetate is sourced from PubChem (CID 8943058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).