4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane

C60H74N8O5Si3 — CID 160717012

About 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane

4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane (PubChem CID 160717012) has the molecular formula C60H74N8O5Si3 and a molecular weight of 1071.56 g/mol. Its IUPAC name is 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane.

Molecular Properties

• Compound Name: 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane
• PubChem CID: 160717012
• Molecular Formula: C60H74N8O5Si3
• Molecular Weight: 1071.56 g/mol
• Exact Mass: 1070.51
• IUPAC Name: 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane
• SMILES: Cc1cc(O)ccc1-c1ccc2c(-c3nc4ccccc4[nH]3)n[nH]c2c1.Cc1cc(OCOCC[Si](C)(C)C)ccc1-c1ccc2c(-c3nc4ccccc4n3COCC[Si](C)(C)C)nn(COCC[Si](C)(C)C)c2c1
• InChI: InChI=1S/C39H58N4O4Si3.C21H16N4O/c1-30-25-32(47-29-46-21-24-50(8,9)10)16-18-33(30)31-15-17-34-37(26-31)43(28-45-20-23-49(5,6)7)41-38(34)39-40-35-13-11-12-14-36(35)42(39)27-44-19-22-48(2,3)4;1-12-10-14(26)7-9-15(12)13-6-8-16-19(11-13)24-25-20(16)21-22-17-4-2-3-5-18(17)23-21/h11-18,25-26H,19-24,27-29H2,1-10H3;2-11,26H,1H3,(H,22,23)(H,24,25)
• InChIKey: RSPILDOFFSPPKE-UHFFFAOYSA-N
• XLogP: 15.13
• TPSA: 150.15 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 11
• Rotatable Bonds: 20
• Heavy Atoms: 76
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1071.56
LogP ≤ 5	15.13
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	11

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane?

The IUPAC name of 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane (CID 160717012) is 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane.

What is the SMILES notation for 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane?

The canonical SMILES for 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane is Cc1cc(O)ccc1-c1ccc2c(-c3nc4ccccc4[nH]3)n[nH]c2c1.Cc1cc(OCOCC[Si](C)(C)C)ccc1-c1ccc2c(-c3nc4ccccc4n3COCC[Si](C)(C)C)nn(COCC[Si](C)(C)C)c2c1.

What is the InChIKey of 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane?

The InChIKey is RSPILDOFFSPPKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C39H58N4O4Si3.C21H16N4O/c1-30-25-32(47-29-46-21-24-50(8,9)10)16-18-33(30)31-15-17-34-37(26-31)43(28-45-20-23-49(5,6)7)41-38(34)39-40-35-13-11-12-14-36(35)42(39)27-44-19-22-48(2,3)4;1-12-10-14(26)7-9-15(12)13-6-8-16-19(11-13)24-25-20(16)21-22-17-4-2-3-5-18(17)23-21/h11-18,25-26H,19-24,27-29H2,1-10H3;2-11,26H,1H3,(H,22,23)(H,24,25).

What are the key properties of 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane?

4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane has a molecular weight of 1071.56 g/mol, XLogP of 15.13, 20 rotatable bonds, 3 hydrogen bond donors, and 11 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[3-(1H-benzimidazol-2-yl)-1H-indazol-6-yl]-3-methylphenol;trimethyl-[2-[[6-[2-methyl-4-(2-trimethylsilylethoxymethoxy)phenyl]-3-[1-(2-trimethylsilylethoxymethyl)benzimidazol-2-yl]indazol-1-yl]methoxy]ethyl]silane is sourced from PubChem (CID 160717012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).