bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane

C60H44Br3Cl3F3N9OSi — CID 160739340

About bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane

bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane (PubChem CID 160739340) has the molecular formula C60H44Br3Cl3F3N9OSi and a molecular weight of 1338.22 g/mol. Its IUPAC name is bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane.

Molecular Properties

• Compound Name: bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane
• PubChem CID: 160739340
• Molecular Formula: C60H44Br3Cl3F3N9OSi
• Molecular Weight: 1338.22 g/mol
• Exact Mass: 1333.00
• IUPAC Name: bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane
• SMILES: C[Si](C)(C)CCOCn1cnc(-c2ccc3ncc(Br)cc3c2)c1-c1cc(Cl)ccc1F.Fc1ccc(Cl)cc1-c1[nH]cnc1-c1ccc2ncc(Br)cc2c1.Fc1ccc(Cl)cc1-c1[nH]cnc1-c1ccc2ncc(Br)cc2c1
• InChI: InChI=1S/C24H24BrClFN3OSi.2C18H10BrClFN3/c1-32(2,3)9-8-31-15-30-14-29-23(24(30)20-12-19(26)5-6-21(20)27)16-4-7-22-17(10-16)11-18(25)13-28-22;2*19-12-6-11-5-10(1-4-16(11)22-8-12)17-18(24-9-23-17)14-7-13(20)2-3-15(14)21/h4-7,10-14H,8-9,15H2,1-3H3;2*1-9H,(H,23,24)
• InChIKey: RVJDYGQBMYGTAR-UHFFFAOYSA-N
• XLogP: 19.33
• TPSA: 123.08 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 8
• Rotatable Bonds: 11
• Heavy Atoms: 80
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1338.22
LogP ≤ 5	19.33
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	8

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 bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane?

The IUPAC name of bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane (CID 160739340) is bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane.

What is the SMILES notation for bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane?

The canonical SMILES for bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane is C[Si](C)(C)CCOCn1cnc(-c2ccc3ncc(Br)cc3c2)c1-c1cc(Cl)ccc1F.Fc1ccc(Cl)cc1-c1[nH]cnc1-c1ccc2ncc(Br)cc2c1.Fc1ccc(Cl)cc1-c1[nH]cnc1-c1ccc2ncc(Br)cc2c1.

What is the InChIKey of bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane?

The InChIKey is RVJDYGQBMYGTAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24BrClFN3OSi.2C18H10BrClFN3/c1-32(2,3)9-8-31-15-30-14-29-23(24(30)20-12-19(26)5-6-21(20)27)16-4-7-22-17(10-16)11-18(25)13-28-22;2*19-12-6-11-5-10(1-4-16(11)22-8-12)17-18(24-9-23-17)14-7-13(20)2-3-15(14)21/h4-7,10-14H,8-9,15H2,1-3H3;2*1-9H,(H,23,24).

What are the key properties of bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane?

bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane has a molecular weight of 1338.22 g/mol, XLogP of 19.33, 11 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for bis(3-bromo-6-[5-(5-chloro-2-fluorophenyl)-1H-imidazol-4-yl]quinoline);2-[[4-(3-bromoquinolin-6-yl)-5-(5-chloro-2-fluorophenyl)imidazol-1-yl]methoxy]ethyl-trimethylsilane is sourced from PubChem (CID 160739340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).