6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole

C37H24F2N8O2 — CID 121350253

IUPAC6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole
SMILESCc1cccc(-c2nc3occn3c2-c2ccc3[nH]ncc3c2)c1.Fc1ccc(-c2nc3occn3c2-c2ccc3nccn3c2)cc1F
InChIInChI=1S/C19H14N4O.C18H10F2N4O/c1-12-3-2-4-13(9-12)17-18(23-7-8-24-19(23)21-17)14-5-6-16-15(10-14)11-20-22-16;19-13-3-1-11(9-14(13)20)16-17(24-7-8-25-18(24)22-16)12-2-4-15-21-5-6-23(15)10-12/h2-11H,1H3,(H,20,22);1-10H
InChIKeyLUCVMLRXJSEPGJ-UHFFFAOYSA-N
MW650.65 g/mol
LogP8.63
Rot. Bonds4

About 6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole

6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole (PubChem CID 121350253) has the molecular formula C37H24F2N8O2 and a molecular weight of 650.65 g/mol. Its IUPAC name is 6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole.

Molecular Properties

Compound Name6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole
PubChem CID121350253
Molecular FormulaC37H24F2N8O2
Molecular Weight650.65 g/mol
Exact Mass650.20
IUPAC Name6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole
SMILESCc1cccc(-c2nc3occn3c2-c2ccc3[nH]ncc3c2)c1.Fc1ccc(-c2nc3occn3c2-c2ccc3nccn3c2)cc1F
InChIInChI=1S/C19H14N4O.C18H10F2N4O/c1-12-3-2-4-13(9-12)17-18(23-7-8-24-19(23)21-17)14-5-6-16-15(10-14)11-20-22-16;19-13-3-1-11(9-14(13)20)16-17(24-7-8-25-18(24)22-16)12-2-4-15-21-5-6-23(15)10-12/h2-11H,1H3,(H,20,22);1-10H
InChIKeyLUCVMLRXJSEPGJ-UHFFFAOYSA-N
XLogP8.63
TPSA106.86 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms49
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500650.65
LogP ≤ 58.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole?
The IUPAC name of 6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole (CID 121350253) is 6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole.
What is the SMILES notation for 6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole?
The canonical SMILES for 6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole is Cc1cccc(-c2nc3occn3c2-c2ccc3[nH]ncc3c2)c1.Fc1ccc(-c2nc3occn3c2-c2ccc3nccn3c2)cc1F.
What is the InChIKey of 6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole?
The InChIKey is LUCVMLRXJSEPGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O.C18H10F2N4O/c1-12-3-2-4-13(9-12)17-18(23-7-8-24-19(23)21-17)14-5-6-16-15(10-14)11-20-22-16;19-13-3-1-11(9-14(13)20)16-17(24-7-8-25-18(24)22-16)12-2-4-15-21-5-6-23(15)10-12/h2-11H,1H3,(H,20,22);1-10H.
What are the key properties of 6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole?
6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole has a molecular weight of 650.65 g/mol, XLogP of 8.63, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(3-methylphenyl)imidazo[2,1-b][1,3]oxazole is sourced from PubChem (CID 121350253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).