1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile

C162H167Cl6N11O16S7 — CID 159161751

About 1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile

1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile (PubChem CID 159161751) has the molecular formula C162H167Cl6N11O16S7 and a molecular weight of 2961.37 g/mol. Its IUPAC name is 1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile.

Molecular Properties

• Compound Name: 1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile
• PubChem CID: 159161751
• Molecular Formula: C162H167Cl6N11O16S7
• Molecular Weight: 2961.37 g/mol
• Exact Mass: 2955.88
• IUPAC Name: 1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile
• SMILES: CCC(O)c1cc2nccc(-c3cc(Cl)cc(C)c3OC3CCCC3)c2s1.CCC(O)c1cc2nccc(-c3cc(Cl)cc(C)c3OC3CCCC3)c2s1.CCC(O)c1cc2ncnc(-c3cc(Cl)cc(C)c3OCC3(C)CCC3)c2s1.Cc1cc(C#N)cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c1OCC1(C)CCC1.Cc1cc(Cl)cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c1OCC12CCCC1C2.Cc1cc(Cl)cc(-c2ccnc3cc(CO)sc23)c1OC1CC2(CCC2)C1.Cc1cc(Cl)cc(-c2ccnc3cc(CO)sc23)c1OC1CCC12CCC2
• InChI: InChI=1S/C26H25ClN2O3S.C26H25N3O3S.C22H25ClN2O2S.2C22H22ClNO2S.2C22H24ClNO2S/c1-15-9-17(27)10-20(24(15)32-14-26-7-2-3-16(26)12-26)19-6-8-28-21-11-18(33-25(19)21)13-29-22(30)4-5-23(29)31;1-16-10-17(13-27)11-20(24(16)32-15-26(2)7-3-8-26)19-6-9-28-21-12-18(33-25(19)21)14-29-22(30)4-5-23(29)31;1-4-17(26)18-10-16-21(28-18)19(25-12-24-16)15-9-14(23)8-13(2)20(15)27-11-22(3)6-5-7-22;1-13-9-14(23)10-17(20(13)26-19-3-7-22(19)5-2-6-22)16-4-8-24-18-11-15(12-25)27-21(16)18;1-13-7-14(23)8-18(20(13)26-15-10-22(11-15)4-2-5-22)17-3-6-24-19-9-16(12-25)27-21(17)19;2*1-3-19(25)20-12-18-22(27-20)16(8-9-24-18)17-11-14(23)10-13(2)21(17)26-15-6-4-5-7-15/h6,8-11,16H,2-5,7,12-14H2,1H3;6,9-12H,3-5,7-8,14-15H2,1-2H3;8-10,12,17,26H,4-7,11H2,1-3H3;4,8-11,19,25H,2-3,5-7,12H2,1H3;3,6-9,15,25H,2,4-5,10-12H2,1H3;2*8-12,15,19,25H,3-7H2,1-2H3
• InChIKey: KKOOYXBGIZUMGR-UHFFFAOYSA-N
• XLogP: 43.47
• TPSA: 367.43 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 32
• Rotatable Bonds: 36
• Heavy Atoms: 202
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2961.37
LogP ≤ 5	43.47
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile?

The IUPAC name of 1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile (CID 159161751) is 1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile.

What is the SMILES notation for 1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile?

The canonical SMILES for 1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile is CCC(O)c1cc2nccc(-c3cc(Cl)cc(C)c3OC3CCCC3)c2s1.CCC(O)c1cc2nccc(-c3cc(Cl)cc(C)c3OC3CCCC3)c2s1.CCC(O)c1cc2ncnc(-c3cc(Cl)cc(C)c3OCC3(C)CCC3)c2s1.Cc1cc(C#N)cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c1OCC1(C)CCC1.Cc1cc(Cl)cc(-c2ccnc3cc(CN4C(=O)CCC4=O)sc23)c1OCC12CCCC1C2.Cc1cc(Cl)cc(-c2ccnc3cc(CO)sc23)c1OC1CC2(CCC2)C1.Cc1cc(Cl)cc(-c2ccnc3cc(CO)sc23)c1OC1CCC12CCC2.

What is the InChIKey of 1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile?

The InChIKey is KKOOYXBGIZUMGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25ClN2O3S.C26H25N3O3S.C22H25ClN2O2S.2C22H22ClNO2S.2C22H24ClNO2S/c1-15-9-17(27)10-20(24(15)32-14-26-7-2-3-16(26)12-26)19-6-8-28-21-11-18(33-25(19)21)13-29-22(30)4-5-23(29)31;1-16-10-17(13-27)11-20(24(16)32-15-26(2)7-3-8-26)19-6-9-28-21-12-18(33-25(19)21)14-29-22(30)4-5-23(29)31;1-4-17(26)18-10-16-21(28-18)19(25-12-24-16)15-9-14(23)8-13(2)20(15)27-11-22(3)6-5-7-22;1-13-9-14(23)10-17(20(13)26-19-3-7-22(19)5-2-6-22)16-4-8-24-18-11-15(12-25)27-21(16)18;1-13-7-14(23)8-18(20(13)26-15-10-22(11-15)4-2-5-22)17-3-6-24-19-9-16(12-25)27-21(17)19;2*1-3-19(25)20-12-18-22(27-20)16(8-9-24-18)17-11-14(23)10-13(2)21(17)26-15-6-4-5-7-15/h6,8-11,16H,2-5,7,12-14H2,1H3;6,9-12H,3-5,7-8,14-15H2,1-2H3;8-10,12,17,26H,4-7,11H2,1-3H3;4,8-11,19,25H,2-3,5-7,12H2,1H3;3,6-9,15,25H,2,4-5,10-12H2,1H3;2*8-12,15,19,25H,3-7H2,1-2H3.

What are the key properties of 1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile?

1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile has a molecular weight of 2961.37 g/mol, XLogP of 43.47, 36 rotatable bonds, 5 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[[7-[2-(1-bicyclo[3.1.0]hexanylmethoxy)-5-chloro-3-methylphenyl]thieno[3,2-b]pyridin-2-yl]methyl]pyrrolidine-2,5-dione;bis(1-[7-(5-chloro-2-cyclopentyloxy-3-methylphenyl)thieno[3,2-b]pyridin-2-yl]propan-1-ol);1-[4-[5-chloro-3-methyl-2-[(1-methylcyclobutyl)methoxy]phenyl]thieno[3,2-d]pyrimidin-6-yl]propan-1-ol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-2-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;[7-(5-chloro-3-methyl-2-spiro[3.3]heptan-3-yloxyphenyl)thieno[3,2-b]pyridin-2-yl]methanol;3-[2-[(2,5-dioxopyrrolidin-1-yl)methyl]thieno[3,2-b]pyridin-7-yl]-5-methyl-4-[(1-methylcyclobutyl)methoxy]benzonitrile is sourced from PubChem (CID 159161751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).