5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole

C12H8N2OS — CID 2745314

IUPAC5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole
SMILESc1ccc(-c2csc(-c3ccno3)n2)cc1
InChIInChI=1S/C12H8N2OS/c1-2-4-9(5-3-1)10-8-16-12(14-10)11-6-7-13-15-11/h1-8H
InChIKeyJMFKJPNVXGXDHI-UHFFFAOYSA-N
MW228.28 g/mol
LogP3.47
Rot. Bonds2

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

5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole (PubChem CID 2745314) has the molecular formula C12H8N2OS and a molecular weight of 228.28 g/mol. Its IUPAC name is 5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole.

Molecular Properties

Compound Name5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole
PubChem CID2745314
Molecular FormulaC12H8N2OS
Molecular Weight228.28 g/mol
Exact Mass228.04
IUPAC Name5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole
SMILESc1ccc(-c2csc(-c3ccno3)n2)cc1
InChIInChI=1S/C12H8N2OS/c1-2-4-9(5-3-1)10-8-16-12(14-10)11-6-7-13-15-11/h1-8H
InChIKeyJMFKJPNVXGXDHI-UHFFFAOYSA-N
XLogP3.47
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.28
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-(2-Chlorophenyl)-1,3-thiazol-4-yl]-5-methyl-1,2-oxazole
CID 1479633
5-[4-(4-Chlorophenyl)-1,3-thiazol-2-yl]isoxazole
CID 2745315
5-{4-[4-(Trifluoromethyl)phenyl]-1,3-thiazol-2-yl}isoxazole
CID 2742520
5-Methyl-4-(2-phenyl-1,3-thiazol-4-yl)isoxazole
CID 1479634
4-(2-Isoxazol-5-yl-1,3-thiazol-4-yl)benzonitrile
CID 2742518
5-[4-(3-Fluorophenyl)-1,3-thiazol-2-yl]isoxazole
CID 2742521
5-[4-(3-Methyl-1-benzothiophen-2-yl)-1,3-thiazol-2-yl]-1,2-oxazole
CID 2742517
5-[4-(3,4-Dichlorophenyl)-1,3-thiazol-2-yl]-1,2-oxazole
CID 2742510
5-[4-(2,4-Dimethylphenyl)-1,3-thiazol-2-yl]-1,2-oxazole
CID 2742514
5-[4-(4-Methylphenyl)-1,3-thiazol-2-yl]-1,2-oxazole
CID 2742515
5-Methyl-4-[2-(1,2-oxazol-5-yl)-1,3-thiazol-4-yl]-3-phenyl-1,2-oxazole
CID 2742519
5-[4-[(4-Chlorophenyl)sulfanylmethyl]-1,3-thiazol-2-yl]-1,2-oxazole
CID 2745396

Frequently Asked Questions

What is the IUPAC name of 5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole?
The IUPAC name of 5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole (CID 2745314) is 5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole.
What is the SMILES notation for 5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole?
The canonical SMILES for 5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole is c1ccc(-c2csc(-c3ccno3)n2)cc1.
What is the InChIKey of 5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole?
The InChIKey is JMFKJPNVXGXDHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8N2OS/c1-2-4-9(5-3-1)10-8-16-12(14-10)11-6-7-13-15-11/h1-8H.
What are the key properties of 5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole?
5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole has a molecular weight of 228.28 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-phenyl-1,3-thiazol-2-yl)-1,2-oxazole is sourced from PubChem (CID 2745314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).