N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine

C172H163N35O9S7 — CID 158289450

About N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine

N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 158289450) has the molecular formula C172H163N35O9S7 and a molecular weight of 3088.90 g/mol. Its IUPAC name is N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

• Compound Name: N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine
• PubChem CID: 158289450
• Molecular Formula: C172H163N35O9S7
• Molecular Weight: 3088.90 g/mol
• Exact Mass: 3086.14
• IUPAC Name: N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine
• SMILES: COCC(C)Nc1nc(-c2ccccn2)nc2sc(-c3ccncc3)c(-c3ccccc3)c12.COCCNc1nc(-c2cccc(C)n2)nc2sc(-c3ccccc3)c(-c3ccccc3)c12.COCCNc1nc(-c2ccccn2)nc2sc(-c3ccccc3)c(-c3ccccn3)c12.COCCNc1nc(-c2nccn2C)nc2sc(-c3ccc(OC)cc3)c(-c3ccccc3)c12.COCCNc1nc(-c2nccn2C)nc2sc(-c3ccncc3)c(-c3ccccc3)c12.COCCNc1nc(-c2nccn2C)nc2sc(C)c(-c3ccccc3)c12.COCCNc1nc(-c2nccn2C)nc2sc(C3CCOCC3)c(-c3ccccc3)c12
• InChI: InChI=1S/C27H24N4OS.C26H25N5O2S.C26H23N5OS.C25H21N5OS.C24H22N6OS.C24H27N5O2S.C20H21N5OS/c1-18-10-9-15-21(29-18)25-30-26(28-16-17-32-2)23-22(19-11-5-3-6-12-19)24(33-27(23)31-25)20-13-7-4-8-14-20;1-31-15-13-28-25(31)24-29-23(27-14-16-32-2)21-20(17-7-5-4-6-8-17)22(34-26(21)30-24)18-9-11-19(33-3)12-10-18;1-17(16-32-2)29-25-22-21(18-8-4-3-5-9-18)23(19-11-14-27-15-12-19)33-26(22)31-24(30-25)20-10-6-7-13-28-20;1-31-16-15-28-24-21-20(18-11-5-7-13-26-18)22(17-9-3-2-4-10-17)32-25(21)30-23(29-24)19-12-6-8-14-27-19;1-30-14-12-27-23(30)22-28-21(26-13-15-31-2)19-18(16-6-4-3-5-7-16)20(32-24(19)29-22)17-8-10-25-11-9-17;1-29-12-10-26-23(29)22-27-21(25-11-15-30-2)19-18(16-6-4-3-5-7-16)20(32-24(19)28-22)17-8-13-31-14-9-17;1-13-15(14-7-5-4-6-8-14)16-17(21-10-12-26-3)23-18(24-20(16)27-13)19-22-9-11-25(19)2/h3-15H,16-17H2,1-2H3,(H,28,30,31);4-13,15H,14,16H2,1-3H3,(H,27,29,30);3-15,17H,16H2,1-2H3,(H,29,30,31);2-14H,15-16H2,1H3,(H,28,29,30);3-12,14H,13,15H2,1-2H3,(H,26,28,29);3-7,10,12,17H,8-9,11,13-15H2,1-2H3,(H,25,27,28);4-9,11H,10,12H2,1-3H3,(H,21,23,24)
• InChIKey: GLEHNOXSOIOWJR-UHFFFAOYSA-N
• XLogP: 37.13
• TPSA: 496.36 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 51
• Rotatable Bonds: 49
• Heavy Atoms: 223
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3088.90
LogP ≤ 5	37.13
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	51

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine?

The IUPAC name of N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine (CID 158289450) is N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine.

What is the SMILES notation for N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine?

The canonical SMILES for N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine is COCC(C)Nc1nc(-c2ccccn2)nc2sc(-c3ccncc3)c(-c3ccccc3)c12.COCCNc1nc(-c2cccc(C)n2)nc2sc(-c3ccccc3)c(-c3ccccc3)c12.COCCNc1nc(-c2ccccn2)nc2sc(-c3ccccc3)c(-c3ccccn3)c12.COCCNc1nc(-c2nccn2C)nc2sc(-c3ccc(OC)cc3)c(-c3ccccc3)c12.COCCNc1nc(-c2nccn2C)nc2sc(-c3ccncc3)c(-c3ccccc3)c12.COCCNc1nc(-c2nccn2C)nc2sc(C)c(-c3ccccc3)c12.COCCNc1nc(-c2nccn2C)nc2sc(C3CCOCC3)c(-c3ccccc3)c12.

What is the InChIKey of N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine?

The InChIKey is GLEHNOXSOIOWJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24N4OS.C26H25N5O2S.C26H23N5OS.C25H21N5OS.C24H22N6OS.C24H27N5O2S.C20H21N5OS/c1-18-10-9-15-21(29-18)25-30-26(28-16-17-32-2)23-22(19-11-5-3-6-12-19)24(33-27(23)31-25)20-13-7-4-8-14-20;1-31-15-13-28-25(31)24-29-23(27-14-16-32-2)21-20(17-7-5-4-6-8-17)22(34-26(21)30-24)18-9-11-19(33-3)12-10-18;1-17(16-32-2)29-25-22-21(18-8-4-3-5-9-18)23(19-11-14-27-15-12-19)33-26(22)31-24(30-25)20-10-6-7-13-28-20;1-31-16-15-28-24-21-20(18-11-5-7-13-26-18)22(17-9-3-2-4-10-17)32-25(21)30-23(29-24)19-12-6-8-14-27-19;1-30-14-12-27-23(30)22-28-21(26-13-15-31-2)19-18(16-6-4-3-5-7-16)20(32-24(19)29-22)17-8-10-25-11-9-17;1-29-12-10-26-23(29)22-27-21(25-11-15-30-2)19-18(16-6-4-3-5-7-16)20(32-24(19)28-22)17-8-13-31-14-9-17;1-13-15(14-7-5-4-6-8-14)16-17(21-10-12-26-3)23-18(24-20(16)27-13)19-22-9-11-25(19)2/h3-15H,16-17H2,1-2H3,(H,28,30,31);4-13,15H,14,16H2,1-3H3,(H,27,29,30);3-15,17H,16H2,1-2H3,(H,29,30,31);2-14H,15-16H2,1H3,(H,28,29,30);3-12,14H,13,15H2,1-2H3,(H,26,28,29);3-7,10,12,17H,8-9,11,13-15H2,1-2H3,(H,25,27,28);4-9,11H,10,12H2,1-3H3,(H,21,23,24).

What are the key properties of N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine?

N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 3088.90 g/mol, XLogP of 37.13, 49 rotatable bonds, 7 hydrogen bond donors, and 51 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2-methoxyethyl)-6-(4-methoxyphenyl)-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-6-(oxan-4-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(1-methylimidazol-2-yl)-5-phenyl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-methyl-2-(1-methylimidazol-2-yl)-5-phenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)-5,6-diphenylthieno[2,3-d]pyrimidin-4-amine;N-(2-methoxyethyl)-6-phenyl-2,5-dipyridin-2-ylthieno[2,3-d]pyrimidin-4-amine;N-(1-methoxypropan-2-yl)-5-phenyl-2-pyridin-2-yl-6-pyridin-4-ylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 158289450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).