2,5-bis(4-chlorophenyl)-1,3-oxazole

C15H9Cl2NO — CID 2798253

IUPAC2,5-bis(4-chlorophenyl)-1,3-oxazole
SMILESClc1ccc(-c2cnc(-c3ccc(Cl)cc3)o2)cc1
InChIInChI=1S/C15H9Cl2NO/c16-12-5-1-10(2-6-12)14-9-18-15(19-14)11-3-7-13(17)8-4-11/h1-9H
InChIKeyZTEVJLDNGCBZHP-UHFFFAOYSA-N
MW290.15 g/mol
LogP5.32
Rot. Bonds2

About 2,5-bis(4-chlorophenyl)-1,3-oxazole

2,5-bis(4-chlorophenyl)-1,3-oxazole (PubChem CID 2798253) has the molecular formula C15H9Cl2NO and a molecular weight of 290.15 g/mol. Its IUPAC name is 2,5-bis(4-chlorophenyl)-1,3-oxazole.

Molecular Properties

Compound Name2,5-bis(4-chlorophenyl)-1,3-oxazole
PubChem CID2798253
Molecular FormulaC15H9Cl2NO
Molecular Weight290.15 g/mol
Exact Mass289.01
IUPAC Name2,5-bis(4-chlorophenyl)-1,3-oxazole
SMILESClc1ccc(-c2cnc(-c3ccc(Cl)cc3)o2)cc1
InChIInChI=1S/C15H9Cl2NO/c16-12-5-1-10(2-6-12)14-9-18-15(19-14)11-3-7-13(17)8-4-11/h1-9H
InChIKeyZTEVJLDNGCBZHP-UHFFFAOYSA-N
XLogP5.32
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.15
LogP ≤ 55.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-bis(4-chlorophenyl)-1,3-oxazole?
The IUPAC name of 2,5-bis(4-chlorophenyl)-1,3-oxazole (CID 2798253) is 2,5-bis(4-chlorophenyl)-1,3-oxazole.
What is the SMILES notation for 2,5-bis(4-chlorophenyl)-1,3-oxazole?
The canonical SMILES for 2,5-bis(4-chlorophenyl)-1,3-oxazole is Clc1ccc(-c2cnc(-c3ccc(Cl)cc3)o2)cc1.
What is the InChIKey of 2,5-bis(4-chlorophenyl)-1,3-oxazole?
The InChIKey is ZTEVJLDNGCBZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9Cl2NO/c16-12-5-1-10(2-6-12)14-9-18-15(19-14)11-3-7-13(17)8-4-11/h1-9H.
What are the key properties of 2,5-bis(4-chlorophenyl)-1,3-oxazole?
2,5-bis(4-chlorophenyl)-1,3-oxazole has a molecular weight of 290.15 g/mol, XLogP of 5.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis(4-chlorophenyl)-1,3-oxazole is sourced from PubChem (CID 2798253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).