5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole

C16H11ClN2O — CID 9038019

IUPAC5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole
SMILESCl/C(=C\c1ccccc1)c1nc(-c2ccccc2)no1
InChIInChI=1S/C16H11ClN2O/c17-14(11-12-7-3-1-4-8-12)16-18-15(19-20-16)13-9-5-2-6-10-13/h1-11H/b14-11-
InChIKeyPGRZNKKWKAZDBI-KAMYIIQDSA-N
MW282.73 g/mol
LogP4.47
Rot. Bonds3

About 5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole

5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole (PubChem CID 9038019) has the molecular formula C16H11ClN2O and a molecular weight of 282.73 g/mol. Its IUPAC name is 5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole
PubChem CID9038019
Molecular FormulaC16H11ClN2O
Molecular Weight282.73 g/mol
Exact Mass282.06
IUPAC Name5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole
SMILESCl/C(=C\c1ccccc1)c1nc(-c2ccccc2)no1
InChIInChI=1S/C16H11ClN2O/c17-14(11-12-7-3-1-4-8-12)16-18-15(19-20-16)13-9-5-2-6-10-13/h1-11H/b14-11-
InChIKeyPGRZNKKWKAZDBI-KAMYIIQDSA-N
XLogP4.47
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.73
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole 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-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenyl]-2,6-dimethylphenol
CID 135574248
5-[(Z)-1-chloro-2-(4-ethoxyphenyl)ethenyl]-3-phenyl-1,2,4-oxadiazole
CID 9038106
5-[(Z)-1-chloro-2-(3,4,5-trimethoxyphenyl)ethenyl]-3-phenyl-1,2,4-oxadiazole
CID 9038059
5-[(Z)-1-chloro-2-phenylethenyl]-3-(2-methoxyphenyl)-1,2,4-oxadiazole
CID 9036804
2-chloro-4-[(Z)-2-chloro-2-(3-phenyl-1,2,4-oxadiazol-5-yl)ethenyl]-6-methoxyphenol
CID 135574251
5-[(Z)-1-chloro-2-(4-methylphenyl)ethenyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole
CID 9041756
3-[(Z)-2-chloro-2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethenyl]phenol
CID 9036620
3-[(Z)-2-chloro-2-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]ethenyl]phenol
CID 9041121
5-[(Z)-1-chloro-2-(4-methoxyphenyl)ethenyl]-3-(3-chlorophenyl)-1,2,4-oxadiazole
CID 9041072
3-(4-chlorophenyl)-5-[(Z)-1-chloro-2-(1-phenylpyrazol-4-yl)ethenyl]-1,2,4-oxadiazole
CID 9039368
5-[(Z)-1-chloro-2-(3-methylphenyl)ethenyl]-3-(3-methoxyphenyl)-1,2,4-oxadiazole
CID 9035621
5-[(Z)-1-chloro-2-(3,4-difluorophenyl)ethenyl]-3-(4-fluorophenyl)-1,2,4-oxadiazole
CID 9036721

Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole?
The IUPAC name of 5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole (CID 9038019) is 5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole.
What is the SMILES notation for 5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole?
The canonical SMILES for 5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole is Cl/C(=C\c1ccccc1)c1nc(-c2ccccc2)no1.
What is the InChIKey of 5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole?
The InChIKey is PGRZNKKWKAZDBI-KAMYIIQDSA-N. The full InChI is InChI=1S/C16H11ClN2O/c17-14(11-12-7-3-1-4-8-12)16-18-15(19-20-16)13-9-5-2-6-10-13/h1-11H/b14-11-.
What are the key properties of 5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole?
5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole has a molecular weight of 282.73 g/mol, XLogP of 4.47, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-1-chloro-2-phenylethenyl]-3-phenyl-1,2,4-oxadiazole is sourced from PubChem (CID 9038019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).