3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate

C128H121N15O13S17 — CID 157212269

About 3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate

3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate (PubChem CID 157212269) has the molecular formula C128H121N15O13S17 and a molecular weight of 2622.61 g/mol. Its IUPAC name is 3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate.

Molecular Properties

• Compound Name: 3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate
• PubChem CID: 157212269
• Molecular Formula: C128H121N15O13S17
• Molecular Weight: 2622.61 g/mol
• Exact Mass: 2619.45
• IUPAC Name: 3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate
• SMILES: CCCCS(=O)c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1NC(=O)OC.CCCCS(=O)c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1NC(C)=O.CCCCS(=O)c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1O.CCCNS(=O)(=O)c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N.CCOCS(=O)c1sc2nc(-c3nccs3)cc(-c3cnc(C)n3C)c2c1O.Nc1c(C(=O)N2CCCCC2)sc2nc(-c3cccs3)cc(-c3ccccc3)c12
• InChI: InChI=1S/C23H21N3OS2.C23H22N2O3S3.C23H22N2O2S3.C21H19NO2S3.C20H19N3O2S3.C18H18N4O3S3/c24-20-19-16(15-8-3-1-4-9-15)14-17(18-10-7-13-28-18)25-22(19)29-21(20)23(27)26-11-5-2-6-12-26;1-3-4-13-31(27)22-20(25-23(26)28-2)19-16(15-9-6-5-7-10-15)14-17(24-21(19)30-22)18-11-8-12-29-18;1-3-4-13-30(27)23-21(24-15(2)26)20-17(16-9-6-5-7-10-16)14-18(25-22(20)29-23)19-11-8-12-28-19;1-2-3-12-27(24)21-19(23)18-15(14-8-5-4-6-9-14)13-16(22-20(18)26-21)17-10-7-11-25-17;1-2-10-22-28(24,25)20-18(21)17-14(13-7-4-3-5-8-13)12-15(23-19(17)27-20)16-9-6-11-26-16;1-4-25-9-28(24)18-15(23)14-11(13-8-20-10(2)22(13)3)7-12(21-17(14)27-18)16-19-5-6-26-16/h1,3-4,7-10,13-14H,2,5-6,11-12,24H2;5-12,14H,3-4,13H2,1-2H3,(H,25,26);5-12,14H,3-4,13H2,1-2H3,(H,24,26);4-11,13,23H,2-3,12H2,1H3;3-9,11-12,22H,2,10,21H2,1H3;5-8,23H,4,9H2,1-3H3
• InChIKey: ASAFQTRRGGIJPM-UHFFFAOYSA-N
• XLogP: 34.44
• TPSA: 411.97 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 36
• Rotatable Bonds: 35
• Heavy Atoms: 173
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2622.61
LogP ≤ 5	34.44
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	36

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'thiophene_hydroxy(28)', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate?

The IUPAC name of 3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate (CID 157212269) is 3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate.

What is the SMILES notation for 3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate?

The canonical SMILES for 3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate is CCCCS(=O)c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1NC(=O)OC.CCCCS(=O)c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1NC(C)=O.CCCCS(=O)c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1O.CCCNS(=O)(=O)c1sc2nc(-c3cccs3)cc(-c3ccccc3)c2c1N.CCOCS(=O)c1sc2nc(-c3nccs3)cc(-c3cnc(C)n3C)c2c1O.Nc1c(C(=O)N2CCCCC2)sc2nc(-c3cccs3)cc(-c3ccccc3)c12.

What is the InChIKey of 3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate?

The InChIKey is ASAFQTRRGGIJPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N3OS2.C23H22N2O3S3.C23H22N2O2S3.C21H19NO2S3.C20H19N3O2S3.C18H18N4O3S3/c24-20-19-16(15-8-3-1-4-9-15)14-17(18-10-7-13-28-18)25-22(19)29-21(20)23(27)26-11-5-2-6-12-26;1-3-4-13-31(27)22-20(25-23(26)28-2)19-16(15-9-6-5-7-10-15)14-17(24-21(19)30-22)18-11-8-12-29-18;1-3-4-13-30(27)23-21(24-15(2)26)20-17(16-9-6-5-7-10-16)14-18(25-22(20)29-23)19-11-8-12-28-19;1-2-3-12-27(24)21-19(23)18-15(14-8-5-4-6-9-14)13-16(22-20(18)26-21)17-10-7-11-25-17;1-2-10-22-28(24,25)20-18(21)17-14(13-7-4-3-5-8-13)12-15(23-19(17)27-20)16-9-6-11-26-16;1-4-25-9-28(24)18-15(23)14-11(13-8-20-10(2)22(13)3)7-12(21-17(14)27-18)16-19-5-6-26-16/h1,3-4,7-10,13-14H,2,5-6,11-12,24H2;5-12,14H,3-4,13H2,1-2H3,(H,25,26);5-12,14H,3-4,13H2,1-2H3,(H,24,26);4-11,13,23H,2-3,12H2,1H3;3-9,11-12,22H,2,10,21H2,1H3;5-8,23H,4,9H2,1-3H3.

What are the key properties of 3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate?

3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate has a molecular weight of 2622.61 g/mol, XLogP of 34.44, 35 rotatable bonds, 7 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 3-amino-4-phenyl-N-propyl-6-thiophen-2-ylthieno[2,3-b]pyridine-2-sulfonamide;(3-amino-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone;2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-ol;N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)acetamide;4-(2,3-dimethylimidazol-4-yl)-2-(ethoxymethylsulfinyl)-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-3-ol;methyl N-(2-butylsulfinyl-4-phenyl-6-thiophen-2-ylthieno[2,3-b]pyridin-3-yl)carbamate is sourced from PubChem (CID 157212269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).