2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane

C102H110BIN10O5Si3 — CID 158033194

About 2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane

2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane (PubChem CID 158033194) has the molecular formula C102H110BIN10O5Si3 and a molecular weight of 1778.04 g/mol. Its IUPAC name is 2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane.

Molecular Properties

• Compound Name: 2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane
• PubChem CID: 158033194
• Molecular Formula: C102H110BIN10O5Si3
• Molecular Weight: 1778.04 g/mol
• Exact Mass: 1776.71
• IUPAC Name: 2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane
• SMILES: C(=C/c1n[nH]c2ccc(-c3cncc4ccccc34)cc12)\c1ccccc1.CC1(C)OB(c2ccc3c(c2)c(/C=C/c2ccccc2)nn3COCC[Si](C)(C)C)OC1(C)C.C[Si](C)(C)CCOCn1nc(/C=C/c2ccccc2)c2cc(-c3cncc4ccccc34)ccc21.C[Si](C)(C)CCOCn1nc(/C=C/c2ccccc2)c2cc(I)ccc21
• InChI: InChI=1S/C30H31N3OSi.C27H37BN2O3Si.C24H17N3.C21H25IN2OSi/c1-35(2,3)18-17-34-22-33-30-16-14-24(28-21-31-20-25-11-7-8-12-26(25)28)19-27(30)29(32-33)15-13-23-9-5-4-6-10-23;1-26(2)27(3,4)33-28(32-26)22-14-16-25-23(19-22)24(15-13-21-11-9-8-10-12-21)29-30(25)20-31-17-18-34(5,6)7;1-2-6-17(7-3-1)10-12-23-21-14-18(11-13-24(21)27-26-23)22-16-25-15-19-8-4-5-9-20(19)22;1-26(2,3)14-13-25-16-24-21-12-10-18(22)15-19(21)20(23-24)11-9-17-7-5-4-6-8-17/h4-16,19-21H,17-18,22H2,1-3H3;8-16,19H,17-18,20H2,1-7H3;1-16H,(H,26,27);4-12,15H,13-14,16H2,1-3H3/b2*15-13+;12-10+;11-9+
• InChIKey: FHKWMXIEHFTVFQ-VSAXBNKTSA-N
• XLogP: 25.62
• TPSA: 154.07 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 14
• Rotatable Bonds: 26
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1778.04
LogP ≤ 5	25.62
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	14

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane?

The IUPAC name of 2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane (CID 158033194) is 2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane.

What is the SMILES notation for 2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane?

The canonical SMILES for 2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane is C(=C/c1n[nH]c2ccc(-c3cncc4ccccc34)cc12)\c1ccccc1.CC1(C)OB(c2ccc3c(c2)c(/C=C/c2ccccc2)nn3COCC[Si](C)(C)C)OC1(C)C.C[Si](C)(C)CCOCn1nc(/C=C/c2ccccc2)c2cc(-c3cncc4ccccc34)ccc21.C[Si](C)(C)CCOCn1nc(/C=C/c2ccccc2)c2cc(I)ccc21.

What is the InChIKey of 2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane?

The InChIKey is FHKWMXIEHFTVFQ-VSAXBNKTSA-N. The full InChI is InChI=1S/C30H31N3OSi.C27H37BN2O3Si.C24H17N3.C21H25IN2OSi/c1-35(2,3)18-17-34-22-33-30-16-14-24(28-21-31-20-25-11-7-8-12-26(25)28)19-27(30)29(32-33)15-13-23-9-5-4-6-10-23;1-26(2)27(3,4)33-28(32-26)22-14-16-25-23(19-22)24(15-13-21-11-9-8-10-12-21)29-30(25)20-31-17-18-34(5,6)7;1-2-6-17(7-3-1)10-12-23-21-14-18(11-13-24(21)27-26-23)22-16-25-15-19-8-4-5-9-20(19)22;1-26(2,3)14-13-25-16-24-21-12-10-18(22)15-19(21)20(23-24)11-9-17-7-5-4-6-8-17/h4-16,19-21H,17-18,22H2,1-3H3;8-16,19H,17-18,20H2,1-7H3;1-16H,(H,26,27);4-12,15H,13-14,16H2,1-3H3/b2*15-13+;12-10+;11-9+.

What are the key properties of 2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane?

2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane has a molecular weight of 1778.04 g/mol, XLogP of 25.62, 26 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[5-iodo-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;2-[[5-isoquinolin-4-yl-3-[(E)-2-phenylethenyl]indazol-1-yl]methoxy]ethyl-trimethylsilane;4-[3-[(E)-2-phenylethenyl]-1H-indazol-5-yl]isoquinoline;trimethyl-[2-[[3-[(E)-2-phenylethenyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazol-1-yl]methoxy]ethyl]silane is sourced from PubChem (CID 158033194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).