7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane

C144H123Cl2F7IN27O17S10 — CID 158286902

About 7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane

7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane (PubChem CID 158286902) has the molecular formula C144H123Cl2F7IN27O17S10 and a molecular weight of 3155.21 g/mol. Its IUPAC name is 7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane.

Molecular Properties

• Compound Name: 7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane
• PubChem CID: 158286902
• Molecular Formula: C144H123Cl2F7IN27O17S10
• Molecular Weight: 3155.21 g/mol
• Exact Mass: 3151.51
• IUPAC Name: 7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane
• SMILES: C1CCOC1.C1CCOC1.CC.COc1ccccc1CC(=O)N=C=S.COc1ccccc1CC(=O)NC(=S)Nc1ccc(Oc2ccnc3cc(-c4cn(C)cn4)sc23)c(F)c1.Clc1ccnc2ccsc12.Cn1cnc(-c2cc3nccc(Cl)c3s2)c1.Cn1cnc(-c2cc3nccc(Oc4ccc(N)cc4F)c3s2)c1.Cn1cnc(-c2cc3nccc(Oc4ccc(NC(=S)NC(=O)Cc5ccccc5F)cc4F)c3s2)c1.Cn1cnc(-c2cc3nccc(Oc4ccc([N+](=O)[O-])cc4F)c3s2)c1.Cn1cnc(I)c1.O=C(Cc1ccccc1F)N=C=S.O=[N+]([O-])c1ccc(O)c(F)c1
• InChI: InChI=1S/C27H22FN5O3S2.C26H19F2N5O2S2.C17H11FN4O3S.C17H13FN4OS.C11H8ClN3S.C10H9NO2S.C9H6FNOS.C7H4ClNS.C6H4FNO3.C4H5IN2.2C4H8O.C2H6/c1-33-14-20(30-15-33)24-13-19-26(38-24)23(9-10-29-19)36-22-8-7-17(12-18(22)28)31-27(37)32-25(34)11-16-5-3-4-6-21(16)35-2;1-33-13-20(30-14-33)23-12-19-25(37-23)22(8-9-29-19)35-21-7-6-16(11-18(21)28)31-26(36)32-24(34)10-15-4-2-3-5-17(15)27;1-21-8-13(20-9-21)16-7-12-17(26-16)15(4-5-19-12)25-14-3-2-10(22(23)24)6-11(14)18;1-22-8-13(21-9-22)16-7-12-17(24-16)15(4-5-20-12)23-14-3-2-10(19)6-11(14)18;1-15-5-9(14-6-15)10-4-8-11(16-10)7(12)2-3-13-8;1-13-9-5-3-2-4-8(9)6-10(12)11-7-14;10-8-4-2-1-3-7(8)5-9(12)11-6-13;8-5-1-3-9-6-2-4-10-7(5)6;7-5-3-4(8(10)11)1-2-6(5)9;1-7-2-4(5)6-3-7;2*1-2-4-5-3-1;1-2/h3-10,12-15H,11H2,1-2H3,(H2,31,32,34,37);2-9,11-14H,10H2,1H3,(H2,31,32,34,36);2-9H,1H3;2-9H,19H2,1H3;2-6H,1H3;2-5H,6H2,1H3;1-4H,5H2;1-4H;1-3,9H;2-3H,1H3;2*1-4H2;1-2H3
• InChIKey: GKWSJOBRVDQLJB-UHFFFAOYSA-N
• XLogP: 35.51
• TPSA: 531.75 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 46
• Rotatable Bonds: 27
• Heavy Atoms: 208
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3155.21
LogP ≤ 5	35.51
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	46

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane?

The IUPAC name of 7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane (CID 158286902) is 7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane.

What is the SMILES notation for 7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane?

The canonical SMILES for 7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane is C1CCOC1.C1CCOC1.CC.COc1ccccc1CC(=O)N=C=S.COc1ccccc1CC(=O)NC(=S)Nc1ccc(Oc2ccnc3cc(-c4cn(C)cn4)sc23)c(F)c1.Clc1ccnc2ccsc12.Cn1cnc(-c2cc3nccc(Cl)c3s2)c1.Cn1cnc(-c2cc3nccc(Oc4ccc(N)cc4F)c3s2)c1.Cn1cnc(-c2cc3nccc(Oc4ccc(NC(=S)NC(=O)Cc5ccccc5F)cc4F)c3s2)c1.Cn1cnc(-c2cc3nccc(Oc4ccc([N+](=O)[O-])cc4F)c3s2)c1.Cn1cnc(I)c1.O=C(Cc1ccccc1F)N=C=S.O=[N+]([O-])c1ccc(O)c(F)c1.

What is the InChIKey of 7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane?

The InChIKey is GKWSJOBRVDQLJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22FN5O3S2.C26H19F2N5O2S2.C17H11FN4O3S.C17H13FN4OS.C11H8ClN3S.C10H9NO2S.C9H6FNOS.C7H4ClNS.C6H4FNO3.C4H5IN2.2C4H8O.C2H6/c1-33-14-20(30-15-33)24-13-19-26(38-24)23(9-10-29-19)36-22-8-7-17(12-18(22)28)31-27(37)32-25(34)11-16-5-3-4-6-21(16)35-2;1-33-13-20(30-14-33)23-12-19-25(37-23)22(8-9-29-19)35-21-7-6-16(11-18(21)28)31-26(36)32-24(34)10-15-4-2-3-5-17(15)27;1-21-8-13(20-9-21)16-7-12-17(26-16)15(4-5-19-12)25-14-3-2-10(22(23)24)6-11(14)18;1-22-8-13(21-9-22)16-7-12-17(24-16)15(4-5-20-12)23-14-3-2-10(19)6-11(14)18;1-15-5-9(14-6-15)10-4-8-11(16-10)7(12)2-3-13-8;1-13-9-5-3-2-4-8(9)6-10(12)11-7-14;10-8-4-2-1-3-7(8)5-9(12)11-6-13;8-5-1-3-9-6-2-4-10-7(5)6;7-5-3-4(8(10)11)1-2-6(5)9;1-7-2-4(5)6-3-7;2*1-2-4-5-3-1;1-2/h3-10,12-15H,11H2,1-2H3,(H2,31,32,34,37);2-9,11-14H,10H2,1H3,(H2,31,32,34,36);2-9H,1H3;2-9H,19H2,1H3;2-6H,1H3;2-5H,6H2,1H3;1-4H,5H2;1-4H;1-3,9H;2-3H,1H3;2*1-4H2;1-2H3.

What are the key properties of 7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane?

7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane has a molecular weight of 3155.21 g/mol, XLogP of 35.51, 27 rotatable bonds, 6 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for 7-chloro-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;7-chlorothieno[3,2-b]pyridine;ethane;3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyaniline;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-fluorophenyl)acetamide;N-[[3-fluoro-4-[2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridin-7-yl]oxyphenyl]carbamothioyl]-2-(2-methoxyphenyl)acetamide;2-fluoro-4-nitrophenol;7-(2-fluoro-4-nitrophenoxy)-2-(1-methylimidazol-4-yl)thieno[3,2-b]pyridine;2-(2-fluorophenyl)acetyl isothiocyanate;4-iodo-1-methylimidazole;2-(2-methoxyphenyl)acetyl isothiocyanate;oxolane is sourced from PubChem (CID 158286902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).