5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole

C35H23N3O — CID 59691056

IUPAC5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole
SMILESc1ccc(-c2ccc(-c3nc4occn4c3-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1
InChIInChI=1S/C35H23N3O/c1-2-8-24(9-3-1)25-14-16-26(17-15-25)33-34(37-22-23-39-35(37)36-33)27-18-20-28(21-19-27)38-31-12-6-4-10-29(31)30-11-5-7-13-32(30)38/h1-23H
InChIKeyZMKXRJYEUZCIJY-UHFFFAOYSA-N
MW501.59 g/mol
LogP9.03
Rot. Bonds4

About 5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole

5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole (PubChem CID 59691056) has the molecular formula C35H23N3O and a molecular weight of 501.59 g/mol. Its IUPAC name is 5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole.

Molecular Properties

Compound Name5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole
PubChem CID59691056
Molecular FormulaC35H23N3O
Molecular Weight501.59 g/mol
Exact Mass501.18
IUPAC Name5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole
SMILESc1ccc(-c2ccc(-c3nc4occn4c3-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1
InChIInChI=1S/C35H23N3O/c1-2-8-24(9-3-1)25-14-16-26(17-15-25)33-34(37-22-23-39-35(37)36-33)27-18-20-28(21-19-27)38-31-12-6-4-10-29(31)30-11-5-7-13-32(30)38/h1-23H
InChIKeyZMKXRJYEUZCIJY-UHFFFAOYSA-N
XLogP9.03
TPSA35.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500501.59
LogP ≤ 59.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole?
The IUPAC name of 5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole (CID 59691056) is 5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole.
What is the SMILES notation for 5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole?
The canonical SMILES for 5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole is c1ccc(-c2ccc(-c3nc4occn4c3-c3ccc(-n4c5ccccc5c5ccccc54)cc3)cc2)cc1.
What is the InChIKey of 5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole?
The InChIKey is ZMKXRJYEUZCIJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H23N3O/c1-2-8-24(9-3-1)25-14-16-26(17-15-25)33-34(37-22-23-39-35(37)36-33)27-18-20-28(21-19-27)38-31-12-6-4-10-29(31)30-11-5-7-13-32(30)38/h1-23H.
What are the key properties of 5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole?
5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole has a molecular weight of 501.59 g/mol, XLogP of 9.03, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-carbazol-9-ylphenyl)-6-(4-phenylphenyl)imidazo[2,1-b][1,3]oxazole is sourced from PubChem (CID 59691056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).