2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole

C17H11ClFNO — CID 8814959

IUPAC2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole
SMILESFc1cccc(/C=C(\Cl)c2ncc(-c3ccccc3)o2)c1
InChIInChI=1S/C17H11ClFNO/c18-15(10-12-5-4-8-14(19)9-12)17-20-11-16(21-17)13-6-2-1-3-7-13/h1-11H/b15-10-
InChIKeyAKFXULHFSARNBD-GDNBJRDFSA-N
MW299.73 g/mol
LogP5.22
Rot. Bonds3

About 2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole

2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole (PubChem CID 8814959) has the molecular formula C17H11ClFNO and a molecular weight of 299.73 g/mol. Its IUPAC name is 2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole.

Molecular Properties

Compound Name2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole
PubChem CID8814959
Molecular FormulaC17H11ClFNO
Molecular Weight299.73 g/mol
Exact Mass299.05
IUPAC Name2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole
SMILESFc1cccc(/C=C(\Cl)c2ncc(-c3ccccc3)o2)c1
InChIInChI=1S/C17H11ClFNO/c18-15(10-12-5-4-8-14(19)9-12)17-20-11-16(21-17)13-6-2-1-3-7-13/h1-11H/b15-10-
InChIKeyAKFXULHFSARNBD-GDNBJRDFSA-N
XLogP5.22
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.73
LogP ≤ 55.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole 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

4-[(Z)-2-chloro-2-(5-phenyl-1,3-oxazol-2-yl)ethenyl]-2,6-dimethoxyphenol
CID 135573709
2-[(Z)-1-chloro-2-[4-(difluoromethoxy)-3-methoxyphenyl]ethenyl]-5-phenyl-1,3-oxazole
CID 8814981
2-[(Z)-1-chloro-2-(3-chloro-4,5-dimethoxyphenyl)ethenyl]-5-phenyl-1,3-oxazole
CID 8814994
2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-(4-chlorophenyl)-1,3,4-oxadiazole
CID 9446940
5-(4-chlorophenyl)-2-[(Z)-1-chloro-2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole
CID 9036392
5-(4-fluorophenyl)-1,3-oxazole-2-carboxylic acid
CID 18695170
2-[(3-fluorophenyl)sulfonylmethyl]-5-phenyl-1,3-oxazole
CID 75512661
2,2,2-trifluoro-1-(5-phenyl-1,3-oxazol-2-yl)ethanone
CID 83389105
sodium 5-phenyl-1,3-oxazole-2-carboxylate
CID 71755872
N-[(3-fluorophenyl)methylideneamino]-5-phenylpyrimidin-2-amine
CID 3107053
1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-3-(5-phenyl-1,3-oxazol-2-yl)propan-1-one
CID 26064309
2-[(Z)-2-(3,4-dimethoxyphenyl)-1-fluoroethenyl]-5-(4-methoxyphenyl)-1,3-oxazole
CID 102202954

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole?
The IUPAC name of 2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole (CID 8814959) is 2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole.
What is the SMILES notation for 2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole?
The canonical SMILES for 2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole is Fc1cccc(/C=C(\Cl)c2ncc(-c3ccccc3)o2)c1.
What is the InChIKey of 2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole?
The InChIKey is AKFXULHFSARNBD-GDNBJRDFSA-N. The full InChI is InChI=1S/C17H11ClFNO/c18-15(10-12-5-4-8-14(19)9-12)17-20-11-16(21-17)13-6-2-1-3-7-13/h1-11H/b15-10-.
What are the key properties of 2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole?
2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole has a molecular weight of 299.73 g/mol, XLogP of 5.22, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-1-chloro-2-(3-fluorophenyl)ethenyl]-5-phenyl-1,3-oxazole is sourced from PubChem (CID 8814959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).