10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline]

C193H134N20O2Si4 — CID 158981211

About 10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline]

10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline] (PubChem CID 158981211) has the molecular formula C193H134N20O2Si4 and a molecular weight of 2877.68 g/mol. Its IUPAC name is 10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline].

Molecular Properties

• Compound Name: 10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline]
• PubChem CID: 158981211
• Molecular Formula: C193H134N20O2Si4
• Molecular Weight: 2877.68 g/mol
• Exact Mass: 2875.01
• IUPAC Name: 10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline]
• SMILES: C[Si]1(C)c2ccccc2N(c2ccc3c4ncccc4n(-c4cccnc4)c3c2)c2ccccc21.Cc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1cc(C)ccc1N2c1ccc2c3ncccc3n(-c3cccnc3)c2c1.c1ccc([Si]2(c3ccccc3)c3ccccc3N(c3ccc4c5ncccc5n(-c5cccnc5)c4c3)c3ccccc32)cc1.c1cncc(-n2c3cc(N4c5ccccc5[Si]5(c6ccccc6-c6ccccc65)c5ccccc54)ccc3c3ncccc32)c1.c1cncc(-n2c3cc(N4c5ccccc5[Si]5(c6ccccc6Oc6ccccc65)c5ccccc54)ccc3c3ncccc32)c1
• InChI: InChI=1S/C43H30N4O.C40H26N4OSi.C40H26N4Si.C40H28N4Si.C30H24N4Si/c1-27-15-19-36-34(23-27)43(32-10-3-5-13-40(32)48-41-14-6-4-11-33(41)43)35-24-28(2)16-20-37(35)46(36)29-17-18-31-39(25-29)47(30-9-7-21-44-26-30)38-12-8-22-45-42(31)38;1-5-17-36-30(12-1)43(27-21-22-29-33(25-27)44(28-11-9-23-41-26-28)32-14-10-24-42-40(29)32)31-13-2-6-18-37(31)46(36)38-19-7-3-15-34(38)45-35-16-4-8-20-39(35)46;1-5-17-36-29(12-1)30-13-2-6-18-37(30)45(36)38-19-7-3-14-32(38)43(33-15-4-8-20-39(33)45)27-21-22-31-35(25-27)44(28-11-9-23-41-26-28)34-16-10-24-42-40(31)34;1-3-14-31(15-4-1)45(32-16-5-2-6-17-32)38-21-9-7-18-34(38)43(35-19-8-10-22-39(35)45)29-23-24-33-37(27-29)44(30-13-11-25-41-28-30)36-20-12-26-42-40(33)36;1-35(2)28-13-5-3-10-24(28)33(25-11-4-6-14-29(25)35)21-15-16-23-27(19-21)34(22-9-7-17-31-20-22)26-12-8-18-32-30(23)26/h3-26H,1-2H3;1-26H;1-26H;1-28H;3-20H,1-2H3
• InChIKey: JPAIMBQEHMWYPT-UHFFFAOYSA-N
• XLogP: 36.93
• TPSA: 188.21 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 12
• Heavy Atoms: 219
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2877.68
LogP ≤ 5	36.93
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline]?

The IUPAC name of 10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline] (CID 158981211) is 10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline].

What is the SMILES notation for 10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline]?

The canonical SMILES for 10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline] is C[Si]1(C)c2ccccc2N(c2ccc3c4ncccc4n(-c4cccnc4)c3c2)c2ccccc21.Cc1ccc2c(c1)C1(c3ccccc3Oc3ccccc31)c1cc(C)ccc1N2c1ccc2c3ncccc3n(-c3cccnc3)c2c1.c1ccc([Si]2(c3ccccc3)c3ccccc3N(c3ccc4c5ncccc5n(-c5cccnc5)c4c3)c3ccccc32)cc1.c1cncc(-n2c3cc(N4c5ccccc5[Si]5(c6ccccc6-c6ccccc65)c5ccccc54)ccc3c3ncccc32)c1.c1cncc(-n2c3cc(N4c5ccccc5[Si]5(c6ccccc6Oc6ccccc65)c5ccccc54)ccc3c3ncccc32)c1.

What is the InChIKey of 10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline]?

The InChIKey is JPAIMBQEHMWYPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H30N4O.C40H26N4OSi.C40H26N4Si.C40H28N4Si.C30H24N4Si/c1-27-15-19-36-34(23-27)43(32-10-3-5-13-40(32)48-41-14-6-4-11-33(41)43)35-24-28(2)16-20-37(35)46(36)29-17-18-31-39(25-29)47(30-9-7-21-44-26-30)38-12-8-22-45-42(31)38;1-5-17-36-30(12-1)43(27-21-22-29-33(25-27)44(28-11-9-23-41-26-28)32-14-10-24-42-40(29)32)31-13-2-6-18-37(31)46(36)38-19-7-3-15-34(38)45-35-16-4-8-20-39(35)46;1-5-17-36-29(12-1)30-13-2-6-18-37(30)45(36)38-19-7-3-14-32(38)43(33-15-4-8-20-39(33)45)27-21-22-31-35(25-27)44(28-11-9-23-41-26-28)34-16-10-24-42-40(31)34;1-3-14-31(15-4-1)45(32-16-5-2-6-17-32)38-21-9-7-18-34(38)43(35-19-8-10-22-39(35)45)29-23-24-33-37(27-29)44(30-13-11-25-41-28-30)36-20-12-26-42-40(33)36;1-35(2)28-13-5-3-10-24(28)33(25-11-4-6-14-29(25)35)21-15-16-23-27(19-21)34(22-9-7-17-31-20-22)26-12-8-18-32-30(23)26/h3-26H,1-2H3;1-26H;1-26H;1-28H;3-20H,1-2H3.

What are the key properties of 10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline]?

10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline] has a molecular weight of 2877.68 g/mol, XLogP of 36.93, 12 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 10,10-dimethyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;2,7-dimethyl-10-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[acridine-9,9'-xanthene];10,10-diphenyl-5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)benzo[b][1,4]benzazasiline;5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,5'-benzo[b][1]benzosilole];5-(5-pyridin-3-ylpyrido[3,2-b]indol-7-yl)spiro[benzo[b][1,4]benzazasiline-10,10'-benzo[b][1,4]benzoxasiline] is sourced from PubChem (CID 158981211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).