6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole

C19H12FN3O — CID 153244005

IUPAC6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole
SMILESFc1ccc(-c2nc3occn3c2-c2ccc3c(c2)C=NC3)cc1
InChIInChI=1S/C19H12FN3O/c20-16-5-3-12(4-6-16)17-18(23-7-8-24-19(23)22-17)13-1-2-14-10-21-11-15(14)9-13/h1-9,11H,10H2
InChIKeyWRZZUGYZRJHOOR-UHFFFAOYSA-N
MW317.32 g/mol
LogP4.33
Rot. Bonds2

About 6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole

6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole (PubChem CID 153244005) has the molecular formula C19H12FN3O and a molecular weight of 317.32 g/mol. Its IUPAC name is 6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole.

Molecular Properties

Compound Name6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole
PubChem CID153244005
Molecular FormulaC19H12FN3O
Molecular Weight317.32 g/mol
Exact Mass317.10
IUPAC Name6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole
SMILESFc1ccc(-c2nc3occn3c2-c2ccc3c(c2)C=NC3)cc1
InChIInChI=1S/C19H12FN3O/c20-16-5-3-12(4-6-16)17-18(23-7-8-24-19(23)22-17)13-1-2-14-10-21-11-15(14)9-13/h1-9,11H,10H2
InChIKeyWRZZUGYZRJHOOR-UHFFFAOYSA-N
XLogP4.33
TPSA42.80 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.32
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-N-[(4-fluorophenyl)methyl]pyrimidin-2-amine
CID 44577212
(E)-N-(2,3-dihydro-1H-inden-2-yloxy)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine
CID 142505396
N-[(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methyl]-2,3-dihydro-1H-inden-2-amine
CID 142505432
(E)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)-N-phenylmethoxymethanimine
CID 142505434
(E)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)-N-[[4-(trifluoromethyl)phenyl]methoxy]methanimine
CID 142505445
p38 Kinase inhibitor 7
CID 11338778
p38 Kinase inhibitor 8
CID 11407497
p38 MAP Kinase-IN-1
CID 11417587
6-(2,4-Difluorophenyl)-5-(3-propan-2-ylbenzotriazol-5-yl)imidazo[2,1-b][1,3]oxazole
CID 49830800
(E)-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)-N-[(2,3,4,5,6-pentafluorophenyl)methoxy]methanimine
CID 142505390
4-[6-(4-fluorophenyl)imidazo[2,1-b][1,3]oxazol-5-yl]-N-(1-phenylethyl)pyrimidin-2-amine
CID 49830403
(E)-N-[(4-tert-butylphenyl)methoxy]-1-(6-naphthalen-2-ylimidazo[2,1-b][1,3]oxazol-5-yl)methanimine
CID 155535509

Frequently Asked Questions

What is the IUPAC name of 6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole?
The IUPAC name of 6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole (CID 153244005) is 6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole.
What is the SMILES notation for 6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole?
The canonical SMILES for 6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole is Fc1ccc(-c2nc3occn3c2-c2ccc3c(c2)C=NC3)cc1.
What is the InChIKey of 6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole?
The InChIKey is WRZZUGYZRJHOOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12FN3O/c20-16-5-3-12(4-6-16)17-18(23-7-8-24-19(23)22-17)13-1-2-14-10-21-11-15(14)9-13/h1-9,11H,10H2.
What are the key properties of 6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole?
6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole has a molecular weight of 317.32 g/mol, XLogP of 4.33, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-fluorophenyl)-5-(1H-isoindol-5-yl)imidazo[2,1-b][1,3]oxazole is sourced from PubChem (CID 153244005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).