4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine

C150H163BCl3F8N27O16S7 — CID 159141645

About 4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine

4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine (PubChem CID 159141645) has the molecular formula C150H163BCl3F8N27O16S7 and a molecular weight of 3093.75 g/mol. Its IUPAC name is 4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine.

Molecular Properties

• Compound Name: 4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine
• PubChem CID: 159141645
• Molecular Formula: C150H163BCl3F8N27O16S7
• Molecular Weight: 3093.75 g/mol
• Exact Mass: 3089.98
• IUPAC Name: 4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine
• SMILES: C1COCCN1.Cc1ccc(N)cc1-c1nc2c(c(N3CCOCC3)n1)SCC2.Cc1ccc(N)cc1-c1nc2c(c(N3CCOCC3)n1)SCC2.Cc1ccc(N)cc1B1OC(C)(C)C(C)(C)O1.Cc1ccc(NC(=O)c2cccc(C(F)F)c2)cc1-c1nc2c(c(N3CCOCC3)n1)S(=O)(=O)CC2.Cc1ccc(NC(=O)c2cccc(C(F)F)c2)cc1-c1nc2c(c(N3CCOCC3)n1)SCC2.Cc1ccc(NC(=O)c2cccc(C(F)F)c2)cc1-c1nc2c(c(N3CCOCC3)n1)SCC2.Clc1nc(Cl)c2c(n1)CCS2.Clc1nc2c(c(N3CCOCC3)n1)SCC2.O=C(O)c1cccc(C(F)F)c1
• InChI: InChI=1S/C25H24F2N4O4S.2C25H24F2N4O2S.2C17H20N4OS.C13H20BNO2.C10H12ClN3OS.C8H6F2O2.C6H4Cl2N2S.C4H9NO/c1-15-5-6-18(28-25(32)17-4-2-3-16(13-17)22(26)27)14-19(15)23-29-20-7-12-36(33,34)21(20)24(30-23)31-8-10-35-11-9-31;2*1-15-5-6-18(28-25(32)17-4-2-3-16(13-17)22(26)27)14-19(15)23-29-20-7-12-34-21(20)24(30-23)31-8-10-33-11-9-31;2*1-11-2-3-12(18)10-13(11)16-19-14-4-9-23-15(14)17(20-16)21-5-7-22-8-6-21;1-9-6-7-10(15)8-11(9)14-16-12(2,3)13(4,5)17-14;11-10-12-7-1-6-16-8(7)9(13-10)14-2-4-15-5-3-14;9-7(10)5-2-1-3-6(4-5)8(11)12;7-5-4-3(1-2-11-4)9-6(8)10-5;1-3-6-4-2-5-1/h2-6,13-14,22H,7-12H2,1H3,(H,28,32);2*2-6,13-14,22H,7-12H2,1H3,(H,28,32);2*2-3,10H,4-9,18H2,1H3;6-8H,15H2,1-5H3;1-6H2;1-4,7H,(H,11,12);1-2H2;5H,1-4H2
• InChIKey: KIDVZLHQOODGIH-UHFFFAOYSA-N
• XLogP: 26.95
• TPSA: 531.80 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 45
• Rotatable Bonds: 23
• Heavy Atoms: 212
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3093.75
LogP ≤ 5	26.95
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	45

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine?

The IUPAC name of 4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine (CID 159141645) is 4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine.

What is the SMILES notation for 4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine?

The canonical SMILES for 4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine is C1COCCN1.Cc1ccc(N)cc1-c1nc2c(c(N3CCOCC3)n1)SCC2.Cc1ccc(N)cc1-c1nc2c(c(N3CCOCC3)n1)SCC2.Cc1ccc(N)cc1B1OC(C)(C)C(C)(C)O1.Cc1ccc(NC(=O)c2cccc(C(F)F)c2)cc1-c1nc2c(c(N3CCOCC3)n1)S(=O)(=O)CC2.Cc1ccc(NC(=O)c2cccc(C(F)F)c2)cc1-c1nc2c(c(N3CCOCC3)n1)SCC2.Cc1ccc(NC(=O)c2cccc(C(F)F)c2)cc1-c1nc2c(c(N3CCOCC3)n1)SCC2.Clc1nc(Cl)c2c(n1)CCS2.Clc1nc2c(c(N3CCOCC3)n1)SCC2.O=C(O)c1cccc(C(F)F)c1.

What is the InChIKey of 4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine?

The InChIKey is KIDVZLHQOODGIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24F2N4O4S.2C25H24F2N4O2S.2C17H20N4OS.C13H20BNO2.C10H12ClN3OS.C8H6F2O2.C6H4Cl2N2S.C4H9NO/c1-15-5-6-18(28-25(32)17-4-2-3-16(13-17)22(26)27)14-19(15)23-29-20-7-12-36(33,34)21(20)24(30-23)31-8-10-35-11-9-31;2*1-15-5-6-18(28-25(32)17-4-2-3-16(13-17)22(26)27)14-19(15)23-29-20-7-12-34-21(20)24(30-23)31-8-10-33-11-9-31;2*1-11-2-3-12(18)10-13(11)16-19-14-4-9-23-15(14)17(20-16)21-5-7-22-8-6-21;1-9-6-7-10(15)8-11(9)14-16-12(2,3)13(4,5)17-14;11-10-12-7-1-6-16-8(7)9(13-10)14-2-4-15-5-3-14;9-7(10)5-2-1-3-6(4-5)8(11)12;7-5-4-3(1-2-11-4)9-6(8)10-5;1-3-6-4-2-5-1/h2-6,13-14,22H,7-12H2,1H3,(H,28,32);2*2-6,13-14,22H,7-12H2,1H3,(H,28,32);2*2-3,10H,4-9,18H2,1H3;6-8H,15H2,1-5H3;1-6H2;1-4,7H,(H,11,12);1-2H2;5H,1-4H2.

What are the key properties of 4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine?

4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine has a molecular weight of 3093.75 g/mol, XLogP of 26.95, 23 rotatable bonds, 8 hydrogen bond donors, and 45 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(2-chloro-6,7-dihydrothieno[3,2-d]pyrimidin-4-yl)morpholine;2,4-dichloro-6,7-dihydrothieno[3,2-d]pyrimidine;3-(difluoromethyl)benzoic acid;bis(3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide);3-(difluoromethyl)-N-[4-methyl-3-(4-morpholin-4-yl-5,5-dioxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)phenyl]benzamide;bis(4-methyl-3-(4-morpholin-4-yl-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl)aniline);4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline;morpholine is sourced from PubChem (CID 159141645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).