5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole

C23H15N3O — CID 59691044

IUPAC5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole
SMILESc1ccc(-c2nc3occn3c2-n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C23H15N3O/c1-2-8-16(9-3-1)21-22(25-14-15-27-23(25)24-21)26-19-12-6-4-10-17(19)18-11-5-7-13-20(18)26/h1-15H
InChIKeyKOLDLWQNBICSMH-UHFFFAOYSA-N
MW349.39 g/mol
LogP5.69
Rot. Bonds2

About 5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole

5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole (PubChem CID 59691044) has the molecular formula C23H15N3O and a molecular weight of 349.39 g/mol. Its IUPAC name is 5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole.

Molecular Properties

Compound Name5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole
PubChem CID59691044
Molecular FormulaC23H15N3O
Molecular Weight349.39 g/mol
Exact Mass349.12
IUPAC Name5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole
SMILESc1ccc(-c2nc3occn3c2-n2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C23H15N3O/c1-2-8-16(9-3-1)21-22(25-14-15-27-23(25)24-21)26-19-12-6-4-10-17(19)18-11-5-7-13-20(18)26/h1-15H
InChIKeyKOLDLWQNBICSMH-UHFFFAOYSA-N
XLogP5.69
TPSA35.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.39
LogP ≤ 55.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole?
The IUPAC name of 5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole (CID 59691044) is 5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole.
What is the SMILES notation for 5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole?
The canonical SMILES for 5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole is c1ccc(-c2nc3occn3c2-n2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of 5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole?
The InChIKey is KOLDLWQNBICSMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H15N3O/c1-2-8-16(9-3-1)21-22(25-14-15-27-23(25)24-21)26-19-12-6-4-10-17(19)18-11-5-7-13-20(18)26/h1-15H.
What are the key properties of 5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole?
5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole has a molecular weight of 349.39 g/mol, XLogP of 5.69, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-carbazol-9-yl-6-phenylimidazo[2,1-b][1,3]oxazole is sourced from PubChem (CID 59691044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).