8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane

C68H49N5Si2 — CID 140954115

About 8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane

8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane (PubChem CID 140954115) has the molecular formula C68H49N5Si2 and a molecular weight of 992.35 g/mol. Its IUPAC name is 8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane.

Molecular Properties

• Compound Name: 8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane
• PubChem CID: 140954115
• Molecular Formula: C68H49N5Si2
• Molecular Weight: 992.35 g/mol
• Exact Mass: 991.35
• IUPAC Name: 8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane
• SMILES: C1=CC2c3ccccc3-n3ccnc3C2C=C1[Si](c1ccccc1)(c1ccccc1)c1cccc(N2c3cc4c5ccccc5n(-c5ccccc5)c4cc3[Si](c3ccccc3)(c3ccccc3)c3cccnc32)c1
• InChI: InChI=1S/C68H49N5Si2/c1-6-22-48(23-7-1)72-62-37-19-17-35-58(62)59-46-64-66(47-63(59)72)75(52-29-12-4-13-30-52,53-31-14-5-15-32-53)65-38-21-41-69-68(65)73(64)49-24-20-33-54(44-49)74(50-25-8-2-9-26-50,51-27-10-3-11-28-51)55-39-40-56-57-34-16-18-36-61(57)71-43-42-70-67(71)60(56)45-55/h1-47,56,60H
• InChIKey: LBPDWZSGHNTDHW-UHFFFAOYSA-N
• XLogP: 10.91
• TPSA: 38.88 Ų
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 75
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	992.35
LogP ≤ 5	10.91
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane?

The IUPAC name of 8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane (CID 140954115) is 8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane.

What is the SMILES notation for 8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane?

The canonical SMILES for 8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane is C1=CC2c3ccccc3-n3ccnc3C2C=C1[Si](c1ccccc1)(c1ccccc1)c1cccc(N2c3cc4c5ccccc5n(-c5ccccc5)c4cc3[Si](c3ccccc3)(c3ccccc3)c3cccnc32)c1.

What is the InChIKey of 8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane?

The InChIKey is LBPDWZSGHNTDHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H49N5Si2/c1-6-22-48(23-7-1)72-62-37-19-17-35-58(62)59-46-64-66(47-63(59)72)75(52-29-12-4-13-30-52,53-31-14-5-15-32-53)65-38-21-41-69-68(65)73(64)49-24-20-33-54(44-49)74(50-25-8-2-9-26-50,51-27-10-3-11-28-51)55-39-40-56-57-34-16-18-36-61(57)71-43-42-70-67(71)60(56)45-55/h1-47,56,60H.

What are the key properties of 8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane?

8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane has a molecular weight of 992.35 g/mol, XLogP of 10.91, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 8b,12a-dihydroimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(10,14,14-triphenyl-10,19,21-triaza-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-21-yl)phenyl]silane is sourced from PubChem (CID 140954115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).