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

C36H19F5N8O2 — CID 121350243

IUPAC6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole
SMILESFc1ccc(-c2nc3occn3c2-c2ccc3[nH]ncc3c2)c(F)c1F.Fc1ccc(-c2nc3occn3c2-c2ccc3nccn3c2)c(F)c1
InChIInChI=1S/C18H9F3N4O.C18H10F2N4O/c19-12-3-2-11(14(20)15(12)21)16-17(25-5-6-26-18(25)23-16)9-1-4-13-10(7-9)8-22-24-13;19-12-2-3-13(14(20)9-12)16-17(24-7-8-25-18(24)22-16)11-1-4-15-21-5-6-23(15)10-11/h1-8H,(H,22,24);1-10H
InChIKeySUYDTPKZPVXGTN-UHFFFAOYSA-N
MW690.59 g/mol
LogP8.74
Rot. Bonds4

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

6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole (PubChem CID 121350243) has the molecular formula C36H19F5N8O2 and a molecular weight of 690.59 g/mol. Its IUPAC name is 6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole.

Molecular Properties

Compound Name6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole
PubChem CID121350243
Molecular FormulaC36H19F5N8O2
Molecular Weight690.59 g/mol
Exact Mass690.16
IUPAC Name6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole
SMILESFc1ccc(-c2nc3occn3c2-c2ccc3[nH]ncc3c2)c(F)c1F.Fc1ccc(-c2nc3occn3c2-c2ccc3nccn3c2)c(F)c1
InChIInChI=1S/C18H9F3N4O.C18H10F2N4O/c19-12-3-2-11(14(20)15(12)21)16-17(25-5-6-26-18(25)23-16)9-1-4-13-10(7-9)8-22-24-13;19-12-2-3-13(14(20)9-12)16-17(24-7-8-25-18(24)22-16)11-1-4-15-21-5-6-23(15)10-11/h1-8H,(H,22,24);1-10H
InChIKeySUYDTPKZPVXGTN-UHFFFAOYSA-N
XLogP8.74
TPSA106.86 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500690.59
LogP ≤ 58.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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

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Frequently Asked Questions

What is the IUPAC name of 6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole?
The IUPAC name of 6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole (CID 121350243) is 6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole.
What is the SMILES notation for 6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole?
The canonical SMILES for 6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole is Fc1ccc(-c2nc3occn3c2-c2ccc3[nH]ncc3c2)c(F)c1F.Fc1ccc(-c2nc3occn3c2-c2ccc3nccn3c2)c(F)c1.
What is the InChIKey of 6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole?
The InChIKey is SUYDTPKZPVXGTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H9F3N4O.C18H10F2N4O/c19-12-3-2-11(14(20)15(12)21)16-17(25-5-6-26-18(25)23-16)9-1-4-13-10(7-9)8-22-24-13;19-12-2-3-13(14(20)9-12)16-17(24-7-8-25-18(24)22-16)11-1-4-15-21-5-6-23(15)10-11/h1-8H,(H,22,24);1-10H.
What are the key properties of 6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole?
6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole has a molecular weight of 690.59 g/mol, XLogP of 8.74, 4 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-difluorophenyl)-5-imidazo[1,2-a]pyridin-6-ylimidazo[2,1-b][1,3]oxazole;5-(1H-indazol-5-yl)-6-(2,3,4-trifluorophenyl)imidazo[2,1-b][1,3]oxazole is sourced from PubChem (CID 121350243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).