imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane

C68H47N5Si2 — CID 140951786

IUPACimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane
SMILESc1ccc(-n2c3ccccc3c3cnc4c(c32)[Si](c2ccccc2)(c2ccccc2)c2ccccc2N4c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccc4c5ccccc5n5ccnc5c4c3)c2)cc1
InChIInChI=1S/C68H47N5Si2/c1-6-23-48(24-7-1)72-62-38-19-17-36-58(62)60-47-70-68-66(65(60)72)75(52-30-12-4-13-31-52,53-32-14-5-15-33-53)64-40-21-20-39-63(64)73(68)49-25-22-34-54(45-49)74(50-26-8-2-9-27-50,51-28-10-3-11-29-51)55-41-42-56-57-35-16-18-37-61(57)71-44-43-69-67(71)59(56)46-55/h1-47H
InChIKeyUBOOEKAXSJRXHU-UHFFFAOYSA-N
MW990.33 g/mol
LogP10.67
Rot. Bonds8

About imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane

imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane (PubChem CID 140951786) has the molecular formula C68H47N5Si2 and a molecular weight of 990.33 g/mol. Its IUPAC name is imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane.

Molecular Properties

Compound Nameimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane
PubChem CID140951786
Molecular FormulaC68H47N5Si2
Molecular Weight990.33 g/mol
Exact Mass989.34
IUPAC Nameimidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane
SMILESc1ccc(-n2c3ccccc3c3cnc4c(c32)[Si](c2ccccc2)(c2ccccc2)c2ccccc2N4c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccc4c5ccccc5n5ccnc5c4c3)c2)cc1
InChIInChI=1S/C68H47N5Si2/c1-6-23-48(24-7-1)72-62-38-19-17-36-58(62)60-47-70-68-66(65(60)72)75(52-30-12-4-13-31-52,53-32-14-5-15-33-53)64-40-21-20-39-63(64)73(68)49-25-22-34-54(45-49)74(50-26-8-2-9-27-50,51-28-10-3-11-29-51)55-41-42-56-57-35-16-18-37-61(57)71-44-43-69-67(71)59(56)46-55/h1-47H
InChIKeyUBOOEKAXSJRXHU-UHFFFAOYSA-N
XLogP10.67
TPSA38.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms75
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500990.33
LogP ≤ 510.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(14,14,21-triphenyl-7,9,21-triaza-14-silapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaen-9-yl)phenyl]silane
CID 140953699
imidazo[1,2-f]phenanthridin-11-yl-diphenyl-(5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[3,2-g]carbazol-10-yl)silane
CID 140953410
[3-(14,14-diphenyl-9-oxa-19,21-diaza-14-silapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1(13),2(10),3,5,7,11,15(20),16,18-nonaen-21-yl)phenyl]-imidazo[1,2-f]phenanthridin-11-yl-diphenylsilane
CID 140953288
14-(3-imidazo[1,2-f]phenanthridin-11-yloxyphenyl)-21,21-diphenyl-9-oxa-12,14-diaza-21-silapentacyclo[11.8.0.02,10.03,8.015,20]henicosa-1,3,5,7,10,12,15,17,19-nonaene
CID 140955007
[3-(14,14-diphenyl-21-thia-3,5-diaza-14-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(13),2(10),4(9),5,7,11,15,17,19-nonaen-3-yl)phenyl]-imidazo[1,2-f]phenanthridin-11-yl-diphenylsilane
CID 140955578
(13,13-diphenyl-12-pyridin-2-yl-[1,4]benzoxasilino[3,2-a]carbazol-10-yl)-imidazo[1,2-f]phenanthridin-11-yl-diphenylsilane
CID 140955845
[3-(14,14-diphenyl-8,10-diaza-21-phospha-14-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4(9),5,7,11,15,17,19-nonaen-10-yl)phenyl]-imidazo[1,2-f]phenanthridin-11-yl-diphenylsilane
CID 162482974
10-[fluoro(imidazo[1,2-f]phenanthridin-11-yl)methyl]-5,13,13-triphenyl-12-pyridin-2-yl-[1,4]benzazasilino[3,2-a]carbazole
CID 140955324
(21,21-diphenyl-14-pyridin-2-yl-10-oxa-14-aza-21-silapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15(20),16,18-nonaen-17-yl)-imidazo[1,2-f]phenanthridin-11-yl-diphenylsilane
CID 140954765
6-imidazo[1,2-f]phenanthridin-11-yloxy-5,13,13-triphenyl-8-pyridin-2-yl-[1,4]benzazasilino[2,3-c]carbazole
CID 140955680
[4-[2-[1-(5,5-diphenylbenzo[b][1]benzosilol-4-yl)carbazol-9-yl]carbazol-9-yl]phenyl]-triphenylsilane
CID 166588951
imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(20-thia-8,10-diazapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14,16,18-nonaen-10-yl)phenyl]silane
CID 140952139

Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane?
The IUPAC name of imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane (CID 140951786) is imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane.
What is the SMILES notation for imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane?
The canonical SMILES for imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane is c1ccc(-n2c3ccccc3c3cnc4c(c32)[Si](c2ccccc2)(c2ccccc2)c2ccccc2N4c2cccc([Si](c3ccccc3)(c3ccccc3)c3ccc4c5ccccc5n5ccnc5c4c3)c2)cc1.
What is the InChIKey of imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane?
The InChIKey is UBOOEKAXSJRXHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H47N5Si2/c1-6-23-48(24-7-1)72-62-38-19-17-36-58(62)60-47-70-68-66(65(60)72)75(52-30-12-4-13-31-52,53-32-14-5-15-33-53)64-40-21-20-39-63(64)73(68)49-25-22-34-54(45-49)74(50-26-8-2-9-27-50,51-28-10-3-11-29-51)55-41-42-56-57-35-16-18-37-61(57)71-44-43-69-67(71)59(56)46-55/h1-47H.
What are the key properties of imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane?
imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane has a molecular weight of 990.33 g/mol, XLogP of 10.67, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-f]phenanthridin-11-yl-diphenyl-[3-(3,21,21-triphenyl-3,12,14-triaza-21-silapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1,4,6,8,10,12,15,17,19-nonaen-14-yl)phenyl]silane is sourced from PubChem (CID 140951786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).