2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane

C58H76BBrN10O10Si2 — CID 162059592

About 2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane

2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane (PubChem CID 162059592) has the molecular formula C58H76BBrN10O10Si2 and a molecular weight of 1220.19 g/mol. Its IUPAC name is 2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane.

Molecular Properties

• Compound Name: 2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane
• PubChem CID: 162059592
• Molecular Formula: C58H76BBrN10O10Si2
• Molecular Weight: 1220.19 g/mol
• Exact Mass: 1218.46
• IUPAC Name: 2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane
• SMILES: COc1ccc(-c2ccc3c(c2)c(-c2ccnc(N4CCOCC4)c2)nn3COCC[Si](C)(C)C)c(OC)n1.COc1ccc(B(O)O)c(OC)n1.C[Si](C)(C)CCOCn1nc(-c2ccnc(N3CCOCC3)c2)c2cc(Br)ccc21
• InChI: InChI=1S/C29H37N5O4Si.C22H29BrN4O2Si.C7H10BNO4/c1-35-27-9-7-23(29(31-27)36-2)21-6-8-25-24(18-21)28(32-34(25)20-38-16-17-39(3,4)5)22-10-11-30-26(19-22)33-12-14-37-15-13-33;1-30(2,3)13-12-29-16-27-20-5-4-18(23)15-19(20)22(25-27)17-6-7-24-21(14-17)26-8-10-28-11-9-26;1-12-6-4-3-5(8(10)11)7(9-6)13-2/h6-11,18-19H,12-17,20H2,1-5H3;4-7,14-15H,8-13,16H2,1-3H3;3-4,10-11H,1-2H3
• InChIKey: YZQNWIAVFXZDPS-UHFFFAOYSA-N
• XLogP: 9.11
• TPSA: 207.98 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 20
• Rotatable Bonds: 20
• Heavy Atoms: 82
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1220.19
LogP ≤ 5	9.11
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	20

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane?

The IUPAC name of 2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane (CID 162059592) is 2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane.

What is the SMILES notation for 2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane?

The canonical SMILES for 2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane is COc1ccc(-c2ccc3c(c2)c(-c2ccnc(N4CCOCC4)c2)nn3COCC[Si](C)(C)C)c(OC)n1.COc1ccc(B(O)O)c(OC)n1.C[Si](C)(C)CCOCn1nc(-c2ccnc(N3CCOCC3)c2)c2cc(Br)ccc21.

What is the InChIKey of 2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane?

The InChIKey is YZQNWIAVFXZDPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H37N5O4Si.C22H29BrN4O2Si.C7H10BNO4/c1-35-27-9-7-23(29(31-27)36-2)21-6-8-25-24(18-21)28(32-34(25)20-38-16-17-39(3,4)5)22-10-11-30-26(19-22)33-12-14-37-15-13-33;1-30(2,3)13-12-29-16-27-20-5-4-18(23)15-19(20)22(25-27)17-6-7-24-21(14-17)26-8-10-28-11-9-26;1-12-6-4-3-5(8(10)11)7(9-6)13-2/h6-11,18-19H,12-17,20H2,1-5H3;4-7,14-15H,8-13,16H2,1-3H3;3-4,10-11H,1-2H3.

What are the key properties of 2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane?

2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane has a molecular weight of 1220.19 g/mol, XLogP of 9.11, 20 rotatable bonds, 2 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[5-bromo-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane;(2,6-dimethoxy-3-pyridinyl)boronic acid;2-[[5-(2,6-dimethoxy-3-pyridinyl)-3-(2-morpholin-4-yl-4-pyridinyl)indazol-1-yl]methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 162059592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).