4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole

C17H12BrN3O — CID 24738828

IUPAC4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole
SMILESCc1onc(-c2ccccc2)c1-c1cn2ccc(Br)cc2n1
InChIInChI=1S/C17H12BrN3O/c1-11-16(17(20-22-11)12-5-3-2-4-6-12)14-10-21-8-7-13(18)9-15(21)19-14/h2-10H,1H3
InChIKeySAFCPWPXBRAYPU-UHFFFAOYSA-N
MW354.21 g/mol
LogP4.73
Rot. Bonds2

About 4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole

4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole (PubChem CID 24738828) has the molecular formula C17H12BrN3O and a molecular weight of 354.21 g/mol. Its IUPAC name is 4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole.

Molecular Properties

Compound Name4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole
PubChem CID24738828
Molecular FormulaC17H12BrN3O
Molecular Weight354.21 g/mol
Exact Mass353.02
IUPAC Name4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole
SMILESCc1onc(-c2ccccc2)c1-c1cn2ccc(Br)cc2n1
InChIInChI=1S/C17H12BrN3O/c1-11-16(17(20-22-11)12-5-3-2-4-6-12)14-10-21-8-7-13(18)9-15(21)19-14/h2-10H,1H3
InChIKeySAFCPWPXBRAYPU-UHFFFAOYSA-N
XLogP4.73
TPSA43.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.21
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole?
The IUPAC name of 4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole (CID 24738828) is 4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole.
What is the SMILES notation for 4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole?
The canonical SMILES for 4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole is Cc1onc(-c2ccccc2)c1-c1cn2ccc(Br)cc2n1.
What is the InChIKey of 4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole?
The InChIKey is SAFCPWPXBRAYPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12BrN3O/c1-11-16(17(20-22-11)12-5-3-2-4-6-12)14-10-21-8-7-13(18)9-15(21)19-14/h2-10H,1H3.
What are the key properties of 4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole?
4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole has a molecular weight of 354.21 g/mol, XLogP of 4.73, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-bromoimidazo[1,2-a]pyridin-2-yl)-5-methyl-3-phenyl-1,2-oxazole is sourced from PubChem (CID 24738828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).