2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole

C30H18N6O3 — CID 102173738

IUPAC2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole
SMILESc1ccc(-c2nnc(-c3cccc(-c4nnc(-c5ccccc5)o4)c3-c3nnc(-c4ccccc4)o3)o2)cc1
InChIInChI=1S/C30H18N6O3/c1-4-11-19(12-5-1)25-31-34-28(37-25)22-17-10-18-23(29-35-32-26(38-29)20-13-6-2-7-14-20)24(22)30-36-33-27(39-30)21-15-8-3-9-16-21/h1-18H
InChIKeyVOHBIKCTTVKWQZ-UHFFFAOYSA-N
MW510.51 g/mol
LogP6.84
Rot. Bonds6

About 2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole

2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole (PubChem CID 102173738) has the molecular formula C30H18N6O3 and a molecular weight of 510.51 g/mol. Its IUPAC name is 2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole
PubChem CID102173738
Molecular FormulaC30H18N6O3
Molecular Weight510.51 g/mol
Exact Mass510.14
IUPAC Name2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole
SMILESc1ccc(-c2nnc(-c3cccc(-c4nnc(-c5ccccc5)o4)c3-c3nnc(-c4ccccc4)o3)o2)cc1
InChIInChI=1S/C30H18N6O3/c1-4-11-19(12-5-1)25-31-34-28(37-25)22-17-10-18-23(29-35-32-26(38-29)20-13-6-2-7-14-20)24(22)30-36-33-27(39-30)21-15-8-3-9-16-21/h1-18H
InChIKeyVOHBIKCTTVKWQZ-UHFFFAOYSA-N
XLogP6.84
TPSA116.76 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500510.51
LogP ≤ 56.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole with MolForge

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Related Compounds

2-phenyl-5-[3,10,11-tris(5-phenyl-1,3,4-oxadiazol-2-yl)tetraphenylen-2-yl]-1,3,4-oxadiazole
CID 59855596
2,5-bis[4-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-1,3,4-oxadiazole
CID 101440187
beryllium;hydride;2-(5-phenyl-1,3,4-oxadiazol-2-yl)phenol
CID 174487083
ethane;2-phenyl-5-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-1,3,4-oxadiazole
CID 144770943
2-phenyl-5-(10-phenylanthracen-9-yl)-1,3,4-oxadiazole
CID 146763008
2-(2-tert-butylphenyl)-5-phenyl-1,3,4-oxadiazole
CID 150681431
bis(2,2-dimethylpropane);2,5-diphenyl-1,3,4-oxadiazole
CID 160836587
N,N-diphenyl-3-[5-[2-[5-[3-(N-phenylanilino)phenyl]-1,3,4-oxadiazol-2-yl]phenyl]-1,3,4-oxadiazol-2-yl]aniline
CID 66614461
3-chloro-2-(5-phenyl-1,3,4-oxadiazol-2-yl)aniline
CID 63663266
2-(3-iodophenyl)-5-phenyl-1,3,4-oxadiazole
CID 749918
2-phenyl-5-(6-phenyl-2-pyridinyl)-1,3,4-oxadiazole
CID 59236801
4-phenyl-N-[4-[2-[2-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]phenyl]phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 59228387

Frequently Asked Questions

What is the IUPAC name of 2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole?
The IUPAC name of 2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole (CID 102173738) is 2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole.
What is the SMILES notation for 2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole?
The canonical SMILES for 2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole is c1ccc(-c2nnc(-c3cccc(-c4nnc(-c5ccccc5)o4)c3-c3nnc(-c4ccccc4)o3)o2)cc1.
What is the InChIKey of 2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole?
The InChIKey is VOHBIKCTTVKWQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H18N6O3/c1-4-11-19(12-5-1)25-31-34-28(37-25)22-17-10-18-23(29-35-32-26(38-29)20-13-6-2-7-14-20)24(22)30-36-33-27(39-30)21-15-8-3-9-16-21/h1-18H.
What are the key properties of 2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole?
2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole has a molecular weight of 510.51 g/mol, XLogP of 6.84, 6 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,3-bis(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-5-phenyl-1,3,4-oxadiazole is sourced from PubChem (CID 102173738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).