8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol

C28H21N3OS2 — CID 137230826

About 8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol

8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol (PubChem CID 137230826) has the molecular formula C28H21N3OS2 and a molecular weight of 479.63 g/mol. Its IUPAC name is 8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol.

Molecular Properties

• Compound Name: 8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol
• PubChem CID: 137230826
• Molecular Formula: C28H21N3OS2
• Molecular Weight: 479.63 g/mol
• Exact Mass: 479.11
• IUPAC Name: 8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol
• SMILES: Oc1c(Cc2ccc(-c3cccs3)s2)nc2c(Cc3ccccc3)nc(-c3ccccc3)cn12
• InChI: InChI=1S/C28H21N3OS2/c32-28-23(17-21-13-14-26(34-21)25-12-7-15-33-25)30-27-22(16-19-8-3-1-4-9-19)29-24(18-31(27)28)20-10-5-2-6-11-20/h1-15,18,32H,16-17H2
• InChIKey: QZRALOFIVUVEAG-UHFFFAOYSA-N
• XLogP: 7.07
• TPSA: 50.42 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 34
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	479.63
LogP ≤ 5	7.07
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol?

The IUPAC name of 8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol (CID 137230826) is 8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol.

What is the SMILES notation for 8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol?

The canonical SMILES for 8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol is Oc1c(Cc2ccc(-c3cccs3)s2)nc2c(Cc3ccccc3)nc(-c3ccccc3)cn12.

What is the InChIKey of 8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol?

The InChIKey is QZRALOFIVUVEAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H21N3OS2/c32-28-23(17-21-13-14-26(34-21)25-12-7-15-33-25)30-27-22(16-19-8-3-1-4-9-19)29-24(18-31(27)28)20-10-5-2-6-11-20/h1-15,18,32H,16-17H2.

What are the key properties of 8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol?

8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol has a molecular weight of 479.63 g/mol, XLogP of 7.07, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 8-benzyl-6-phenyl-2-[(5-thiophen-2-ylthiophen-2-yl)methyl]imidazo[1,2-a]pyrazin-3-ol is sourced from PubChem (CID 137230826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).