[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate

C114H164Br2Cl3N25O16Si5 — CID 158268275

About [4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate

[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate (PubChem CID 158268275) has the molecular formula C114H164Br2Cl3N25O16Si5 and a molecular weight of 2547.32 g/mol. Its IUPAC name is [4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate.

Molecular Properties

• Compound Name: [4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate
• PubChem CID: 158268275
• Molecular Formula: C114H164Br2Cl3N25O16Si5
• Molecular Weight: 2547.32 g/mol
• Exact Mass: 2541.91
• IUPAC Name: [4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate
• SMILES: CCCCOc1nc(N)c2c(n1)c(Br)cn2COCC[Si](C)(C)C.CCCCOc1nc(N)c2c(n1)c(C(O)c1ccc(Cl)nc1)cn2COCC[Si](C)(C)C.CCCCOc1nc(N)c2c(n1)c(Cc1ccc(C(=O)OC)nc1)c(Br)n2COCC[Si](C)(C)C.CCCCOc1nc(N)c2c(n1)c(Cc1ccc(C(=O)OC)nc1)cn2COCC[Si](C)(C)C.CCCCOc1nc(N)c2c(n1)c(Cc1ccc(Cl)nc1)cn2COCC[Si](C)(C)C.O=Cc1ccc(Cl)nc1
• InChI: InChI=1S/C24H34BrN5O4Si.C24H35N5O4Si.C22H32ClN5O3Si.C22H32ClN5O2Si.C16H27BrN4O2Si.C6H4ClNO/c1-6-7-10-34-24-28-19-17(13-16-8-9-18(27-14-16)23(31)32-2)21(25)30(20(19)22(26)29-24)15-33-11-12-35(3,4)5;1-6-7-10-33-24-27-20-18(13-17-8-9-19(26-14-17)23(30)31-2)15-29(21(20)22(25)28-24)16-32-11-12-34(3,4)5;1-5-6-9-31-22-26-18-16(20(29)15-7-8-17(23)25-12-15)13-28(19(18)21(24)27-22)14-30-10-11-32(2,3)4;1-5-6-9-30-22-26-19-17(12-16-7-8-18(23)25-13-16)14-28(20(19)21(24)27-22)15-29-10-11-31(2,3)4;1-5-6-7-23-16-19-13-12(17)10-21(14(13)15(18)20-16)11-22-8-9-24(2,3)4;7-6-2-1-5(4-9)3-8-6/h8-9,14H,6-7,10-13,15H2,1-5H3,(H2,26,28,29);8-9,14-15H,6-7,10-13,16H2,1-5H3,(H2,25,27,28);7-8,12-13,20,29H,5-6,9-11,14H2,1-4H3,(H2,24,26,27);7-8,13-14H,5-6,9-12,15H2,1-4H3,(H2,24,26,27);10H,5-9,11H2,1-4H3,(H2,18,19,20);1-4H
• InChIKey: GISKZMDOJFSSMW-UHFFFAOYSA-N
• XLogP: 24.91
• TPSA: 530.30 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 41
• Rotatable Bonds: 56
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2547.32
LogP ≤ 5	24.91
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	41

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate?

The IUPAC name of [4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate (CID 158268275) is [4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate.

What is the SMILES notation for [4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate?

The canonical SMILES for [4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate is CCCCOc1nc(N)c2c(n1)c(Br)cn2COCC[Si](C)(C)C.CCCCOc1nc(N)c2c(n1)c(C(O)c1ccc(Cl)nc1)cn2COCC[Si](C)(C)C.CCCCOc1nc(N)c2c(n1)c(Cc1ccc(C(=O)OC)nc1)c(Br)n2COCC[Si](C)(C)C.CCCCOc1nc(N)c2c(n1)c(Cc1ccc(C(=O)OC)nc1)cn2COCC[Si](C)(C)C.CCCCOc1nc(N)c2c(n1)c(Cc1ccc(Cl)nc1)cn2COCC[Si](C)(C)C.O=Cc1ccc(Cl)nc1.

What is the InChIKey of [4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate?

The InChIKey is GISKZMDOJFSSMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H34BrN5O4Si.C24H35N5O4Si.C22H32ClN5O3Si.C22H32ClN5O2Si.C16H27BrN4O2Si.C6H4ClNO/c1-6-7-10-34-24-28-19-17(13-16-8-9-18(27-14-16)23(31)32-2)21(25)30(20(19)22(26)29-24)15-33-11-12-35(3,4)5;1-6-7-10-33-24-27-20-18(13-17-8-9-19(26-14-17)23(30)31-2)15-29(21(20)22(25)28-24)16-32-11-12-34(3,4)5;1-5-6-9-31-22-26-18-16(20(29)15-7-8-17(23)25-12-15)13-28(19(18)21(24)27-22)14-30-10-11-32(2,3)4;1-5-6-9-30-22-26-19-17(12-16-7-8-18(23)25-13-16)14-28(20(19)21(24)27-22)15-29-10-11-31(2,3)4;1-5-6-7-23-16-19-13-12(17)10-21(14(13)15(18)20-16)11-22-8-9-24(2,3)4;7-6-2-1-5(4-9)3-8-6/h8-9,14H,6-7,10-13,15H2,1-5H3,(H2,26,28,29);8-9,14-15H,6-7,10-13,16H2,1-5H3,(H2,25,27,28);7-8,12-13,20,29H,5-6,9-11,14H2,1-4H3,(H2,24,26,27);7-8,13-14H,5-6,9-12,15H2,1-4H3,(H2,24,26,27);10H,5-9,11H2,1-4H3,(H2,18,19,20);1-4H.

What are the key properties of [4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate?

[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate has a molecular weight of 2547.32 g/mol, XLogP of 24.91, 56 rotatable bonds, 6 hydrogen bond donors, and 41 hydrogen bond acceptors.

Where does this data come from?

All data for [4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]-(6-chloro-3-pyridinyl)methanol;7-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;2-butoxy-7-[(6-chloro-3-pyridinyl)methyl]-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-4-amine;6-chloropyridine-3-carbaldehyde;methyl 5-[[4-amino-6-bromo-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate;methyl 5-[[4-amino-2-butoxy-5-(2-trimethylsilylethoxymethyl)pyrrolo[3,2-d]pyrimidin-7-yl]methyl]pyridine-2-carboxylate is sourced from PubChem (CID 158268275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).