7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine

C₉₁H₁₀₇BBr₃Cl₃N₁₆O₁₈S₈ — CID 159931227

About 7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine

7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine (PubChem CID 159931227) has the molecular formula C₉₁H₁₀₇BBr₃Cl₃N₁₆O₁₈S₈ and a molecular weight of 2326.37 g/mol. Its IUPAC name is 7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine.

Molecular Properties

• Compound Name: 7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine
• PubChem CID: 159931227
• Molecular Formula: C₉₁H₁₀₇BBr₃Cl₃N₁₆O₁₈S₈
• Molecular Weight: 2326.37 g/mol
• Exact Mass: 2320.24
• IUPAC Name: 7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine
• SMILES: C1COCCN1.COc1ncc(-c2nc(Cl)nc3c(Br)csc23)cc1CS(=O)(=O)C1CC1.COc1ncc(-c2nc(N3CCOCC3)nc3c(Br)csc23)cc1CS(=O)(=O)C1CC1.COc1ncc(-c2nc(N3CCOCC3)nc3c(CN4CCC(C(C)(C)O)CC4)csc23)cc1CS(=O)(=O)C1CC1.COc1ncc(B2OC(C)(C)C(C)(C)O2)cc1CS(=O)(=O)C1CC1.Clc1nc(Cl)c2scc(Br)c2n1
• InChI: InChI=1S/C29H39N5O5S2.C20H21BrN4O4S2.C16H24BNO5S.C16H13BrClN3O3S2.C6HBrCl2N2S.C4H9NO/c1-29(2,35)22-6-8-33(9-7-22)16-21-17-40-26-24(31-28(32-25(21)26)34-10-12-39-13-11-34)19-14-20(27(38-3)30-15-19)18-41(36,37)23-4-5-23;1-28-19-13(11-31(26,27)14-2-3-14)8-12(9-22-19)16-18-17(15(21)10-30-18)24-20(23-16)25-4-6-29-7-5-25;1-15(2)16(3,4)23-17(22-15)12-8-11(14(21-5)18-9-12)10-24(19,20)13-6-7-13;1-24-15-9(7-26(22,23)10-2-3-10)4-8(5-19-15)12-14-13(11(17)6-25-14)21-16(18)20-12;7-2-1-12-4-3(2)10-6(9)11-5(4)8;1-3-6-4-2-5-1/h14-15,17,22-23,35H,4-13,16,18H2,1-3H3;8-10,14H,2-7,11H2,1H3;8-9,13H,6-7,10H2,1-5H3;4-6,10H,2-3,7H2,1H3;1H;5H,1-4H2
• InChIKey: NZQVWEGIIJUGRI-UHFFFAOYSA-N
• XLogP: 16.19
• TPSA: 416.29 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 38
• Rotatable Bonds: 25
• Heavy Atoms: 140
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2326.37
LogP ≤ 5	16.19
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	38

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine?

The IUPAC name of 7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine (CID 159931227) is 7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine.

What is the SMILES notation for 7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine?

The canonical SMILES for 7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine is C1COCCN1.COc1ncc(-c2nc(Cl)nc3c(Br)csc23)cc1CS(=O)(=O)C1CC1.COc1ncc(-c2nc(N3CCOCC3)nc3c(Br)csc23)cc1CS(=O)(=O)C1CC1.COc1ncc(-c2nc(N3CCOCC3)nc3c(CN4CCC(C(C)(C)O)CC4)csc23)cc1CS(=O)(=O)C1CC1.COc1ncc(B2OC(C)(C)C(C)(C)O2)cc1CS(=O)(=O)C1CC1.Clc1nc(Cl)c2scc(Br)c2n1.

What is the InChIKey of 7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine?

The InChIKey is NZQVWEGIIJUGRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H39N5O5S2.C20H21BrN4O4S2.C16H24BNO5S.C16H13BrClN3O3S2.C6HBrCl2N2S.C4H9NO/c1-29(2,35)22-6-8-33(9-7-22)16-21-17-40-26-24(31-28(32-25(21)26)34-10-12-39-13-11-34)19-14-20(27(38-3)30-15-19)18-41(36,37)23-4-5-23;1-28-19-13(11-31(26,27)14-2-3-14)8-12(9-22-19)16-18-17(15(21)10-30-18)24-20(23-16)25-4-6-29-7-5-25;1-15(2)16(3,4)23-17(22-15)12-8-11(14(21-5)18-9-12)10-24(19,20)13-6-7-13;1-24-15-9(7-26(22,23)10-2-3-10)4-8(5-19-15)12-14-13(11(17)6-25-14)21-16(18)20-12;7-2-1-12-4-3(2)10-6(9)11-5(4)8;1-3-6-4-2-5-1/h14-15,17,22-23,35H,4-13,16,18H2,1-3H3;8-10,14H,2-7,11H2,1H3;8-9,13H,6-7,10H2,1-5H3;4-6,10H,2-3,7H2,1H3;1H;5H,1-4H2.

What are the key properties of 7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine?

7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine has a molecular weight of 2326.37 g/mol, XLogP of 16.19, 25 rotatable bonds, 2 hydrogen bond donors, and 38 hydrogen bond acceptors.

Where does this data come from?

All data for 7-bromo-2-chloro-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidine;4-[7-bromo-4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]thieno[3,2-d]pyrimidin-2-yl]morpholine;7-bromo-2,4-dichlorothieno[3,2-d]pyrimidine;2-[1-[[4-[5-(cyclopropylsulfonylmethyl)-6-methoxy-3-pyridinyl]-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;3-(cyclopropylsulfonylmethyl)-2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine;morpholine is sourced from PubChem (CID 159931227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 159931227 — identifiers, structure, computed properties (public domain)

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