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

C15H10ClNO — CID 727543

IUPAC5-(4-chlorophenyl)-2-phenyl-1,3-oxazole
SMILESClc1ccc(-c2cnc(-c3ccccc3)o2)cc1
InChIInChI=1S/C15H10ClNO/c16-13-8-6-11(7-9-13)14-10-17-15(18-14)12-4-2-1-3-5-12/h1-10H
InChIKeyWSIOZFWOUNEWBI-UHFFFAOYSA-N
MW255.70 g/mol
LogP4.66
Rot. Bonds2

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

5-(4-chlorophenyl)-2-phenyl-1,3-oxazole (PubChem CID 727543) has the molecular formula C15H10ClNO and a molecular weight of 255.70 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-2-phenyl-1,3-oxazole.

Molecular Properties

Compound Name5-(4-chlorophenyl)-2-phenyl-1,3-oxazole
PubChem CID727543
Molecular FormulaC15H10ClNO
Molecular Weight255.70 g/mol
Exact Mass255.05
IUPAC Name5-(4-chlorophenyl)-2-phenyl-1,3-oxazole
SMILESClc1ccc(-c2cnc(-c3ccccc3)o2)cc1
InChIInChI=1S/C15H10ClNO/c16-13-8-6-11(7-9-13)14-10-17-15(18-14)12-4-2-1-3-5-12/h1-10H
InChIKeyWSIOZFWOUNEWBI-UHFFFAOYSA-N
XLogP4.66
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.70
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-chlorophenyl)-2-phenyl-1,3-oxazole?
The IUPAC name of 5-(4-chlorophenyl)-2-phenyl-1,3-oxazole (CID 727543) is 5-(4-chlorophenyl)-2-phenyl-1,3-oxazole.
What is the SMILES notation for 5-(4-chlorophenyl)-2-phenyl-1,3-oxazole?
The canonical SMILES for 5-(4-chlorophenyl)-2-phenyl-1,3-oxazole is Clc1ccc(-c2cnc(-c3ccccc3)o2)cc1.
What is the InChIKey of 5-(4-chlorophenyl)-2-phenyl-1,3-oxazole?
The InChIKey is WSIOZFWOUNEWBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClNO/c16-13-8-6-11(7-9-13)14-10-17-15(18-14)12-4-2-1-3-5-12/h1-10H.
What are the key properties of 5-(4-chlorophenyl)-2-phenyl-1,3-oxazole?
5-(4-chlorophenyl)-2-phenyl-1,3-oxazole has a molecular weight of 255.70 g/mol, XLogP of 4.66, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-2-phenyl-1,3-oxazole is sourced from PubChem (CID 727543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).