2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one

C76H77F5N16O7S2 — CID 157147418

About 2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one

2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one (PubChem CID 157147418) has the molecular formula C76H77F5N16O7S2 and a molecular weight of 1485.68 g/mol. Its IUPAC name is 2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one.

Molecular Properties

• Compound Name: 2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one
• PubChem CID: 157147418
• Molecular Formula: C76H77F5N16O7S2
• Molecular Weight: 1485.68 g/mol
• Exact Mass: 1484.55
• IUPAC Name: 2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one
• SMILES: Cc1cc(C2(c3cccc(-c4cccnc4)c3)N=C(N)N(C)C2=O)ccc1OC(C)F.Cc1cc(C2(c3cccc(F)c3)N=C(N)N(C)C2=S)ccc1OC(C)F.Cc1cc(C2(c3cncnc3)N=C(N)N(C)C2=O)ccc1OC(C)F.Cc1cc(C2(c3cncs3)N=C(N)N(C)C2=O)ccc1OC(C)F
• InChI: InChI=1S/C24H23FN4O2.C19H19F2N3OS.C17H18FN5O2.C16H17FN4O2S/c1-15-12-20(9-10-21(15)31-16(2)25)24(22(30)29(3)23(26)28-24)19-8-4-6-17(13-19)18-7-5-11-27-14-18;1-11-9-14(7-8-16(11)25-12(2)20)19(13-5-4-6-15(21)10-13)17(26)24(3)18(22)23-19;1-10-6-12(4-5-14(10)25-11(2)18)17(13-7-20-9-21-8-13)15(24)23(3)16(19)22-17;1-9-6-11(4-5-12(9)23-10(2)17)16(13-7-19-8-24-13)14(22)21(3)15(18)20-16/h4-14,16H,1-3H3,(H2,26,28);4-10,12H,1-3H3,(H2,22,23);4-9,11H,1-3H3,(H2,19,22);4-8,10H,1-3H3,(H2,18,20)
• InChIKey: AKWDDGHDSIQWBV-UHFFFAOYSA-N
• XLogP: 11.13
• TPSA: 306.17 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 21
• Rotatable Bonds: 17
• Heavy Atoms: 106
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1485.68
LogP ≤ 5	11.13
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	21

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one?

The IUPAC name of 2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one (CID 157147418) is 2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one.

What is the SMILES notation for 2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one?

The canonical SMILES for 2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one is Cc1cc(C2(c3cccc(-c4cccnc4)c3)N=C(N)N(C)C2=O)ccc1OC(C)F.Cc1cc(C2(c3cccc(F)c3)N=C(N)N(C)C2=S)ccc1OC(C)F.Cc1cc(C2(c3cncnc3)N=C(N)N(C)C2=O)ccc1OC(C)F.Cc1cc(C2(c3cncs3)N=C(N)N(C)C2=O)ccc1OC(C)F.

What is the InChIKey of 2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one?

The InChIKey is AKWDDGHDSIQWBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN4O2.C19H19F2N3OS.C17H18FN5O2.C16H17FN4O2S/c1-15-12-20(9-10-21(15)31-16(2)25)24(22(30)29(3)23(26)28-24)19-8-4-6-17(13-19)18-7-5-11-27-14-18;1-11-9-14(7-8-16(11)25-12(2)20)19(13-5-4-6-15(21)10-13)17(26)24(3)18(22)23-19;1-10-6-12(4-5-14(10)25-11(2)18)17(13-7-20-9-21-8-13)15(24)23(3)16(19)22-17;1-9-6-11(4-5-12(9)23-10(2)17)16(13-7-19-8-24-13)14(22)21(3)15(18)20-16/h4-14,16H,1-3H3,(H2,26,28);4-10,12H,1-3H3,(H2,22,23);4-9,11H,1-3H3,(H2,19,22);4-8,10H,1-3H3,(H2,18,20).

What are the key properties of 2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one?

2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one has a molecular weight of 1485.68 g/mol, XLogP of 11.13, 17 rotatable bonds, 4 hydrogen bond donors, and 21 hydrogen bond acceptors.

Where does this data come from?

All data for 2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-5-(3-fluorophenyl)-3-methylimidazole-4-thione;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(3-pyridin-3-ylphenyl)imidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-pyrimidin-5-ylimidazol-4-one;2-amino-5-[4-(1-fluoroethoxy)-3-methylphenyl]-3-methyl-5-(1,3-thiazol-5-yl)imidazol-4-one is sourced from PubChem (CID 157147418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).