2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine

C105H109N23O5S10 — CID 157386272

About 2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine

2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine (PubChem CID 157386272) has the molecular formula C105H109N23O5S10 and a molecular weight of 2093.85 g/mol. Its IUPAC name is 2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine.

Molecular Properties

• Compound Name: 2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine
• PubChem CID: 157386272
• Molecular Formula: C105H109N23O5S10
• Molecular Weight: 2093.85 g/mol
• Exact Mass: 2091.62
• IUPAC Name: 2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine
• SMILES: CCCCS(=O)c1sc2nc(-c3ccccn3)cc(-c3cnc(C)n3C)c2c1N.CCCCS(=O)c1sc2nc(-c3cccnc3)cc(-c3ccccc3)c2c1N.CCCCS(=O)c1sc2nc(-c3cccnc3)cc(-c3cnc(C)n3C)c2c1N.CCCCS(=O)c1sc2nc(-c3cncnc3)cc(-c3ccccc3)c2c1N.CCCCS(=O)c1sc2nc(-c3cncnc3)cc(-c3cnc(C)n3C)c2c1N
• InChI: InChI=1S/C22H21N3OS2.2C21H23N5OS2.C21H20N4OS2.C20H22N6OS2/c1-2-3-12-28(26)22-20(23)19-17(15-8-5-4-6-9-15)13-18(25-21(19)27-22)16-10-7-11-24-14-16;1-4-5-10-29(27)21-19(22)18-14(17-12-24-13(2)26(17)3)11-16(25-20(18)28-21)15-8-6-7-9-23-15;1-4-5-9-29(27)21-19(22)18-15(17-12-24-13(2)26(17)3)10-16(25-20(18)28-21)14-7-6-8-23-11-14;1-2-3-9-28(26)21-19(22)18-16(14-7-5-4-6-8-14)10-17(25-20(18)27-21)15-11-23-13-24-12-15;1-4-5-6-29(27)20-18(21)17-14(16-10-24-12(2)26(16)3)7-15(25-19(17)28-20)13-8-22-11-23-9-13/h4-11,13-14H,2-3,12,23H2,1H3;6-9,11-12H,4-5,10,22H2,1-3H3;6-8,10-12H,4-5,9,22H2,1-3H3;4-8,10-13H,2-3,9,22H2,1H3;7-11H,4-6,21H2,1-3H3
• InChIKey: BLLWEIKFXJOHRF-UHFFFAOYSA-N
• XLogP: 23.49
• TPSA: 423.59 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 33
• Rotatable Bonds: 30
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2093.85
LogP ≤ 5	23.49
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	33

Frequently Asked Questions

What is the IUPAC name of 2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine?

The IUPAC name of 2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine (CID 157386272) is 2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine.

What is the SMILES notation for 2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine?

The canonical SMILES for 2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine is CCCCS(=O)c1sc2nc(-c3ccccn3)cc(-c3cnc(C)n3C)c2c1N.CCCCS(=O)c1sc2nc(-c3cccnc3)cc(-c3ccccc3)c2c1N.CCCCS(=O)c1sc2nc(-c3cccnc3)cc(-c3cnc(C)n3C)c2c1N.CCCCS(=O)c1sc2nc(-c3cncnc3)cc(-c3ccccc3)c2c1N.CCCCS(=O)c1sc2nc(-c3cncnc3)cc(-c3cnc(C)n3C)c2c1N.

What is the InChIKey of 2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine?

The InChIKey is BLLWEIKFXJOHRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3OS2.2C21H23N5OS2.C21H20N4OS2.C20H22N6OS2/c1-2-3-12-28(26)22-20(23)19-17(15-8-5-4-6-9-15)13-18(25-21(19)27-22)16-10-7-11-24-14-16;1-4-5-10-29(27)21-19(22)18-14(17-12-24-13(2)26(17)3)11-16(25-20(18)28-21)15-8-6-7-9-23-15;1-4-5-9-29(27)21-19(22)18-15(17-12-24-13(2)26(17)3)10-16(25-20(18)28-21)14-7-6-8-23-11-14;1-2-3-9-28(26)21-19(22)18-16(14-7-5-4-6-8-14)10-17(25-20(18)27-21)15-11-23-13-24-12-15;1-4-5-6-29(27)20-18(21)17-14(16-10-24-12(2)26(16)3)7-15(25-19(17)28-20)13-8-22-11-23-9-13/h4-11,13-14H,2-3,12,23H2,1H3;6-9,11-12H,4-5,10,22H2,1-3H3;6-8,10-12H,4-5,9,22H2,1-3H3;4-8,10-13H,2-3,9,22H2,1H3;7-11H,4-6,21H2,1-3H3.

What are the key properties of 2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine?

2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine has a molecular weight of 2093.85 g/mol, XLogP of 23.49, 30 rotatable bonds, 5 hydrogen bond donors, and 33 hydrogen bond acceptors.

Where does this data come from?

All data for 2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-2-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-(2,3-dimethylimidazol-4-yl)-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-3-amine;2-butylsulfinyl-4-phenyl-6-pyrimidin-5-ylthieno[2,3-b]pyridin-3-amine is sourced from PubChem (CID 157386272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).