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

C87H95BBr3Cl3F12N16O18S8 — CID 158107900

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

7-bromo-2-chloro-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidine;7-bromo-2,4-dichloro-6-methylthieno[3,2-d]pyrimidine;4-[7-bromo-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidin-2-yl]morpholine;2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethylsulfonylmethyl)pyridine;2-[1-[[4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methyl-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;morpholine (PubChem CID 158107900) has the molecular formula C87H95BBr3Cl3F12N16O18S8 and a molecular weight of 2494.21 g/mol. Its IUPAC name is 7-bromo-2-chloro-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidine;7-bromo-2,4-dichloro-6-methylthieno[3,2-d]pyrimidine;4-[7-bromo-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidin-2-yl]morpholine;2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethylsulfonylmethyl)pyridine;2-[1-[[4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methyl-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;morpholine.

Molecular Properties

• Compound Name: 7-bromo-2-chloro-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidine;7-bromo-2,4-dichloro-6-methylthieno[3,2-d]pyrimidine;4-[7-bromo-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidin-2-yl]morpholine;2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethylsulfonylmethyl)pyridine;2-[1-[[4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methyl-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;morpholine
• PubChem CID: 158107900
• Molecular Formula: C87H95BBr3Cl3F12N16O18S8
• Molecular Weight: 2494.21 g/mol
• Exact Mass: 2488.13
• IUPAC Name: 7-bromo-2-chloro-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidine;7-bromo-2,4-dichloro-6-methylthieno[3,2-d]pyrimidine;4-[7-bromo-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidin-2-yl]morpholine;2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethylsulfonylmethyl)pyridine;2-[1-[[4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methyl-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;morpholine
• SMILES: C1COCCN1.COc1ncc(-c2nc(Cl)nc3c(Br)c(C)sc23)cc1CS(=O)(=O)C(F)(F)F.COc1ncc(-c2nc(N3CCOCC3)nc3c(Br)c(C)sc23)cc1CS(=O)(=O)C(F)(F)F.COc1ncc(-c2nc(N3CCOCC3)nc3c(CN4CCC(C(C)(C)O)CC4)c(C)sc23)cc1CS(=O)(=O)C(F)(F)F.COc1ncc(B2OC(C)(C)C(C)(C)O2)cc1CS(=O)(=O)C(F)(F)F.Cc1sc2c(Cl)nc(Cl)nc2c1Br
• InChI: InChI=1S/C28H36F3N5O5S2.C19H18BrF3N4O4S2.C15H10BrClF3N3O3S2.C14H19BF3NO5S.C7H3BrCl2N2S.C4H9NO/c1-17-21(15-35-7-5-20(6-8-35)27(2,3)37)23-24(42-17)22(33-26(34-23)36-9-11-41-12-10-36)18-13-19(25(40-4)32-14-18)16-43(38,39)28(29,30)31;1-10-13(20)15-16(32-10)14(25-18(26-15)27-3-5-31-6-4-27)11-7-12(17(30-2)24-8-11)9-33(28,29)19(21,22)23;1-6-9(16)11-12(27-6)10(22-14(17)23-11)7-3-8(13(26-2)21-4-7)5-28(24,25)15(18,19)20;1-12(2)13(3,4)24-15(23-12)10-6-9(11(22-5)19-7-10)8-25(20,21)14(16,17)18;1-2-3(8)4-5(13-2)6(9)12-7(10)11-4;1-3-6-4-2-5-1/h13-14,20,37H,5-12,15-16H2,1-4H3;7-8H,3-6,9H2,1-2H3;3-4H,5H2,1-2H3;6-7H,8H2,1-5H3;1H3;5H,1-4H2
• InChIKey: FQBIQCRMSWDDHN-UHFFFAOYSA-N
• XLogP: 18.85
• TPSA: 416.29 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 38
• Rotatable Bonds: 21
• Heavy Atoms: 148
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2494.21
LogP ≤ 5	18.85
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-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidine;7-bromo-2,4-dichloro-6-methylthieno[3,2-d]pyrimidine;4-[7-bromo-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidin-2-yl]morpholine;2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethylsulfonylmethyl)pyridine;2-[1-[[4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methyl-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;morpholine?

The IUPAC name of 7-bromo-2-chloro-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidine;7-bromo-2,4-dichloro-6-methylthieno[3,2-d]pyrimidine;4-[7-bromo-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidin-2-yl]morpholine;2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethylsulfonylmethyl)pyridine;2-[1-[[4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methyl-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;morpholine (CID 158107900) is 7-bromo-2-chloro-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidine;7-bromo-2,4-dichloro-6-methylthieno[3,2-d]pyrimidine;4-[7-bromo-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidin-2-yl]morpholine;2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethylsulfonylmethyl)pyridine;2-[1-[[4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methyl-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;morpholine.

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

The canonical SMILES for 7-bromo-2-chloro-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidine;7-bromo-2,4-dichloro-6-methylthieno[3,2-d]pyrimidine;4-[7-bromo-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidin-2-yl]morpholine;2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethylsulfonylmethyl)pyridine;2-[1-[[4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methyl-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;morpholine is C1COCCN1.COc1ncc(-c2nc(Cl)nc3c(Br)c(C)sc23)cc1CS(=O)(=O)C(F)(F)F.COc1ncc(-c2nc(N3CCOCC3)nc3c(Br)c(C)sc23)cc1CS(=O)(=O)C(F)(F)F.COc1ncc(-c2nc(N3CCOCC3)nc3c(CN4CCC(C(C)(C)O)CC4)c(C)sc23)cc1CS(=O)(=O)C(F)(F)F.COc1ncc(B2OC(C)(C)C(C)(C)O2)cc1CS(=O)(=O)C(F)(F)F.Cc1sc2c(Cl)nc(Cl)nc2c1Br.

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

The InChIKey is FQBIQCRMSWDDHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H36F3N5O5S2.C19H18BrF3N4O4S2.C15H10BrClF3N3O3S2.C14H19BF3NO5S.C7H3BrCl2N2S.C4H9NO/c1-17-21(15-35-7-5-20(6-8-35)27(2,3)37)23-24(42-17)22(33-26(34-23)36-9-11-41-12-10-36)18-13-19(25(40-4)32-14-18)16-43(38,39)28(29,30)31;1-10-13(20)15-16(32-10)14(25-18(26-15)27-3-5-31-6-4-27)11-7-12(17(30-2)24-8-11)9-33(28,29)19(21,22)23;1-6-9(16)11-12(27-6)10(22-14(17)23-11)7-3-8(13(26-2)21-4-7)5-28(24,25)15(18,19)20;1-12(2)13(3,4)24-15(23-12)10-6-9(11(22-5)19-7-10)8-25(20,21)14(16,17)18;1-2-3(8)4-5(13-2)6(9)12-7(10)11-4;1-3-6-4-2-5-1/h13-14,20,37H,5-12,15-16H2,1-4H3;7-8H,3-6,9H2,1-2H3;3-4H,5H2,1-2H3;6-7H,8H2,1-5H3;1H3;5H,1-4H2.

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

7-bromo-2-chloro-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidine;7-bromo-2,4-dichloro-6-methylthieno[3,2-d]pyrimidine;4-[7-bromo-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidin-2-yl]morpholine;2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethylsulfonylmethyl)pyridine;2-[1-[[4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methyl-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;morpholine has a molecular weight of 2494.21 g/mol, XLogP of 18.85, 21 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-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidine;7-bromo-2,4-dichloro-6-methylthieno[3,2-d]pyrimidine;4-[7-bromo-4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methylthieno[3,2-d]pyrimidin-2-yl]morpholine;2-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3-(trifluoromethylsulfonylmethyl)pyridine;2-[1-[[4-[6-methoxy-5-(trifluoromethylsulfonylmethyl)-3-pyridinyl]-6-methyl-2-morpholin-4-ylthieno[3,2-d]pyrimidin-7-yl]methyl]piperidin-4-yl]propan-2-ol;morpholine is sourced from PubChem (CID 158107900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).