8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol

C71H63F2N9O3 — CID 157207624

About 8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol

8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol (PubChem CID 157207624) has the molecular formula C71H63F2N9O3 and a molecular weight of 1128.34 g/mol. Its IUPAC name is 8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol.

Molecular Properties

• Compound Name: 8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol
• PubChem CID: 157207624
• Molecular Formula: C71H63F2N9O3
• Molecular Weight: 1128.34 g/mol
• Exact Mass: 1127.50
• IUPAC Name: 8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol
• SMILES: Cc1ccc(Cc2nc3c(C(C)C)nc(-c4ccccc4)cn3c2O)cc1.Cc1ccc(Cc2nc3c(C)nc(-c4ccccc4)cn3c2O)cc1.Cc1ccc(Cc2nc3c(Cc4ccccc4)nc(-c4ccc(F)c(F)c4)cn3c2O)cc1
• InChI: InChI=1S/C27H21F2N3O.C23H23N3O.C21H19N3O/c1-17-7-9-19(10-8-17)14-24-27(33)32-16-25(20-11-12-21(28)22(29)15-20)30-23(26(32)31-24)13-18-5-3-2-4-6-18;1-15(2)21-22-25-19(13-17-11-9-16(3)10-12-17)23(27)26(22)14-20(24-21)18-7-5-4-6-8-18;1-14-8-10-16(11-9-14)12-18-21(25)24-13-19(17-6-4-3-5-7-17)22-15(2)20(24)23-18/h2-12,15-16,33H,13-14H2,1H3;4-12,14-15,27H,13H2,1-3H3;3-11,13,25H,12H2,1-2H3
• InChIKey: XAOKYIKIXZCILR-UHFFFAOYSA-N
• XLogP: 15.30
• TPSA: 151.26 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 12
• Rotatable Bonds: 12
• Heavy Atoms: 85
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1128.34
LogP ≤ 5	15.30
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of 8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol?

The IUPAC name of 8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol (CID 157207624) is 8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol.

What is the SMILES notation for 8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol?

The canonical SMILES for 8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol is Cc1ccc(Cc2nc3c(C(C)C)nc(-c4ccccc4)cn3c2O)cc1.Cc1ccc(Cc2nc3c(C)nc(-c4ccccc4)cn3c2O)cc1.Cc1ccc(Cc2nc3c(Cc4ccccc4)nc(-c4ccc(F)c(F)c4)cn3c2O)cc1.

What is the InChIKey of 8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol?

The InChIKey is XAOKYIKIXZCILR-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H21F2N3O.C23H23N3O.C21H19N3O/c1-17-7-9-19(10-8-17)14-24-27(33)32-16-25(20-11-12-21(28)22(29)15-20)30-23(26(32)31-24)13-18-5-3-2-4-6-18;1-15(2)21-22-25-19(13-17-11-9-16(3)10-12-17)23(27)26(22)14-20(24-21)18-7-5-4-6-8-18;1-14-8-10-16(11-9-14)12-18-21(25)24-13-19(17-6-4-3-5-7-17)22-15(2)20(24)23-18/h2-12,15-16,33H,13-14H2,1H3;4-12,14-15,27H,13H2,1-3H3;3-11,13,25H,12H2,1-2H3.

What are the key properties of 8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol?

8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol has a molecular weight of 1128.34 g/mol, XLogP of 15.30, 12 rotatable bonds, 3 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for 8-benzyl-6-(3,4-difluorophenyl)-2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyrazin-3-ol;8-methyl-2-[(4-methylphenyl)methyl]-6-phenylimidazo[1,2-a]pyrazin-3-ol;2-[(4-methylphenyl)methyl]-6-phenyl-8-propan-2-ylimidazo[1,2-a]pyrazin-3-ol is sourced from PubChem (CID 157207624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).