5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one

C14H10Cl2N2O3 — CID 57226038

IUPAC5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one
SMILESO=C1OC(Oc2ccc(Cl)cc2)NN1c1ccccc1Cl
InChIInChI=1S/C14H10Cl2N2O3/c15-9-5-7-10(8-6-9)20-13-17-18(14(19)21-13)12-4-2-1-3-11(12)16/h1-8,13,17H
InChIKeyBCBOZYLLVZRAJC-UHFFFAOYSA-N
MW325.15 g/mol
LogP3.82
Rot. Bonds3

About 5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one

5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one (PubChem CID 57226038) has the molecular formula C14H10Cl2N2O3 and a molecular weight of 325.15 g/mol. Its IUPAC name is 5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one.

Molecular Properties

Compound Name5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one
PubChem CID57226038
Molecular FormulaC14H10Cl2N2O3
Molecular Weight325.15 g/mol
Exact Mass324.01
IUPAC Name5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one
SMILESO=C1OC(Oc2ccc(Cl)cc2)NN1c1ccccc1Cl
InChIInChI=1S/C14H10Cl2N2O3/c15-9-5-7-10(8-6-9)20-13-17-18(14(19)21-13)12-4-2-1-3-11(12)16/h1-8,13,17H
InChIKeyBCBOZYLLVZRAJC-UHFFFAOYSA-N
XLogP3.82
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.15
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one?
The IUPAC name of 5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one (CID 57226038) is 5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one.
What is the SMILES notation for 5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one?
The canonical SMILES for 5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one is O=C1OC(Oc2ccc(Cl)cc2)NN1c1ccccc1Cl.
What is the InChIKey of 5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one?
The InChIKey is BCBOZYLLVZRAJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2N2O3/c15-9-5-7-10(8-6-9)20-13-17-18(14(19)21-13)12-4-2-1-3-11(12)16/h1-8,13,17H.
What are the key properties of 5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one?
5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one has a molecular weight of 325.15 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenoxy)-3-(2-chlorophenyl)-1,3,4-oxadiazolidin-2-one is sourced from PubChem (CID 57226038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).