2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate

C19H11FNO4- — CID 59384678

IUPAC2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate
SMILESO=C([O-])Cc1nc(-c2ccc(F)cc2)oc1-c1ccc2occc2c1
InChIInChI=1S/C19H12FNO4/c20-14-4-1-11(2-5-14)19-21-15(10-17(22)23)18(25-19)13-3-6-16-12(9-13)7-8-24-16/h1-9H,10H2,(H,22,23)/p-1
InChIKeyOEVBSDFCORJVJD-UHFFFAOYSA-M
MW336.30 g/mol
LogP3.19
Rot. Bonds4

About 2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate

2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate (PubChem CID 59384678) has the molecular formula C19H11FNO4- and a molecular weight of 336.30 g/mol. Its IUPAC name is 2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate.

Molecular Properties

Compound Name2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate
PubChem CID59384678
Molecular FormulaC19H11FNO4-
Molecular Weight336.30 g/mol
Exact Mass336.07
IUPAC Name2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate
SMILESO=C([O-])Cc1nc(-c2ccc(F)cc2)oc1-c1ccc2occc2c1
InChIInChI=1S/C19H12FNO4/c20-14-4-1-11(2-5-14)19-21-15(10-17(22)23)18(25-19)13-3-6-16-12(9-13)7-8-24-16/h1-9H,10H2,(H,22,23)/p-1
InChIKeyOEVBSDFCORJVJD-UHFFFAOYSA-M
XLogP3.19
TPSA79.30 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.30
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]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-[2-(4-fluorophenyl)-5-(2-hydroxyphenyl)-1,3-oxazol-4-yl]acetic acid
CID 59384660
methyl 2-[2-(4-fluorophenyl)-5-quinolin-6-yl-1,3-oxazol-4-yl]acetate
CID 142178792
ethyl 2-[2-(4-fluorophenyl)-5-(furan-3-yl)-1,3-oxazol-4-yl]acetate
CID 13392297
5-[1-benzofuran-5-yl-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]sulfamoyl]-2-ethylbenzoic acid
CID 69419523
3-[2-(4-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]propanoic acid
CID 82131267
sodium 2-[4-(5-chlorothiophen-2-yl)-2-(4-fluorophenyl)-1,3-oxazol-5-yl]acetate
CID 67547495
5-(1-benzofuran-5-yl)-2-methyl-1H-pyrrole-3-carboxylic acid
CID 82387639
1-[3-(1-benzofuran-5-yl)-2-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]but-2-enyl]-1-hydroxyurea
CID 173333748
2-[2-(4-methylsulfanylphenyl)-5-thiophen-3-yl-1,3-oxazol-4-yl]acetic acid
CID 59384476
2-[5-(5-chlorothiophen-2-yl)-2-[4-(methylsulfanylmethyl)phenyl]-1,3-oxazol-4-yl]acetate
CID 59384707
4-(1-benzofuran-5-yl)-N,2-dimethyl-N-[[(3R)-pyrrolidin-3-yl]methyl]benzamide
CID 71276798
ethyl 2-[2-(4-fluorophenyl)-5-(5-formyl-4-methylthiophen-2-yl)-1,3-oxazol-4-yl]acetate
CID 59384959

Frequently Asked Questions

What is the IUPAC name of 2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate?
The IUPAC name of 2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate (CID 59384678) is 2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate.
What is the SMILES notation for 2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate?
The canonical SMILES for 2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate is O=C([O-])Cc1nc(-c2ccc(F)cc2)oc1-c1ccc2occc2c1.
What is the InChIKey of 2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate?
The InChIKey is OEVBSDFCORJVJD-UHFFFAOYSA-M. The full InChI is InChI=1S/C19H12FNO4/c20-14-4-1-11(2-5-14)19-21-15(10-17(22)23)18(25-19)13-3-6-16-12(9-13)7-8-24-16/h1-9H,10H2,(H,22,23)/p-1.
What are the key properties of 2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate?
2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate has a molecular weight of 336.30 g/mol, XLogP of 3.19, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(1-benzofuran-5-yl)-2-(4-fluorophenyl)-1,3-oxazol-4-yl]acetate is sourced from PubChem (CID 59384678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).