dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane

C75H48N6OSi — CID 177070079

IUPACdibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane
SMILES[2H]c1c([2H])c([2H])c(-n2c3ccccc3c3c([2H])c([2H])c4c(c5c([2H])c([2H])c([2H])c([2H])c5n4-c4nc(-c5c([2H])c([2H])c([2H])c([Si](c6ccccc6)(c6ccc7oc8ccccc8c7c6)c6c([2H])c([2H])c([2H])c([2H])c6[2H])c5[2H])nc(-c5c([2H])c([2H])c([2H])c([2H])c5-n5c6c([2H])c([2H])c([2H])c([2H])c6c6c([2H])c([2H])c([2H])c([2H])c65)n4)c32)c([2H])c1[2H]
InChIInChI=1S/C75H48N6OSi/c1-4-24-50(25-5-1)79-63-37-16-12-33-57(63)59-44-45-68-71(72(59)79)60-35-13-19-40-66(60)81(68)75-77-73(76-74(78-75)61-36-14-20-41-67(61)80-64-38-17-10-31-55(64)56-32-11-18-39-65(56)80)49-23-22-30-53(47-49)83(51-26-6-2-7-27-51,52-28-8-3-9-29-52)54-43-46-70-62(48-54)58-34-15-21-42-69(58)82-70/h1-48H/i1D,2D,4D,5D,6D,7D,10D,11D,13D,14D,17D,18D,19D,20D,22D,23D,24D,25D,26D,27D,30D,31D,32D,35D,36D,38D,39D,40D,41D,44D,45D,47D
InChIKeyNDNHVWSDYZFJSD-DMOLUDBTSA-N
MW1109.53 g/mol
LogP15.77
Rot. Bonds9

About dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane

dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane (PubChem CID 177070079) has the molecular formula C75H48N6OSi and a molecular weight of 1109.53 g/mol. Its IUPAC name is dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane.

Molecular Properties

Compound Namedibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane
PubChem CID177070079
Molecular FormulaC75H48N6OSi
Molecular Weight1109.53 g/mol
Exact Mass1108.57
IUPAC Namedibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane
SMILES[2H]c1c([2H])c([2H])c(-n2c3ccccc3c3c([2H])c([2H])c4c(c5c([2H])c([2H])c([2H])c([2H])c5n4-c4nc(-c5c([2H])c([2H])c([2H])c([Si](c6ccccc6)(c6ccc7oc8ccccc8c7c6)c6c([2H])c([2H])c([2H])c([2H])c6[2H])c5[2H])nc(-c5c([2H])c([2H])c([2H])c([2H])c5-n5c6c([2H])c([2H])c([2H])c([2H])c6c6c([2H])c([2H])c([2H])c([2H])c65)n4)c32)c([2H])c1[2H]
InChIInChI=1S/C75H48N6OSi/c1-4-24-50(25-5-1)79-63-37-16-12-33-57(63)59-44-45-68-71(72(59)79)60-35-13-19-40-66(60)81(68)75-77-73(76-74(78-75)61-36-14-20-41-67(61)80-64-38-17-10-31-55(64)56-32-11-18-39-65(56)80)49-23-22-30-53(47-49)83(51-26-6-2-7-27-51,52-28-8-3-9-29-52)54-43-46-70-62(48-54)58-34-15-21-42-69(58)82-70/h1-48H/i1D,2D,4D,5D,6D,7D,10D,11D,13D,14D,17D,18D,19D,20D,22D,23D,24D,25D,26D,27D,30D,31D,32D,35D,36D,38D,39D,40D,41D,44D,45D,47D
InChIKeyNDNHVWSDYZFJSD-DMOLUDBTSA-N
XLogP15.77
TPSA66.60 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms83
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001109.53
LogP ≤ 515.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane with MolForge

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Related Compounds

tris(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4-(1,2,3,4,6,7-hexadeuterio-[1]benzofuro[3,2-c]carbazol-5-yl)-6-[2-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane
CID 177070030
diphenyl-[2,3,4,6-tetradeuterio-5-[4-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-[2,3,4,6-tetradeuterio-5-(9-phenylcarbazol-3-yl)phenyl]silane
CID 177070078
triphenyl-[2,3,4,6-tetradeuterio-5-[4-[2-(1,2,3,4,5,6,7-heptadeuteriocarbazol-9-yl)-5-triphenylsilylphenyl]-6-(2-triphenylsilylcarbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]silane
CID 171467495
(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4-[1,2,4,5,7,8-hexadeuterio-3,6-bis(2,3,4,5,6-pentadeuteriophenyl)carbazol-9-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-[2,3,4,6-tetradeuterio-5-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-(2,3,5,6-tetradeuterio-4-phenylphenyl)silane
CID 177070136
[2,3,4,6-tetradeuterio-5-[4-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-tris[2,3,4,6-tetradeuterio-5-(2,3,4,5,6-pentadeuteriophenyl)phenyl]silane
CID 177070155
tris(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4-(6,7,8,9,10,12-hexadeuterio-[1]benzofuro[3,2-b]carbazol-11-yl)-6-[2-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane
CID 177070116
bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[1,2,3,4,5,7,8-heptadeuterio-6-(2,3,4,5,6-pentadeuteriophenyl)carbazol-9-yl]phenyl]-[2,3,4,6-tetradeuterio-5-[4-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane
CID 177070026
(2,3,4,5,6-pentadeuteriophenyl)-diphenyl-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]silane
CID 164843270
[3-[4-carbazol-9-yl-6-(2,3,4,5,6-pentadeuteriophenyl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-triphenylsilane
CID 164843236
[3-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]-dibenzofuran-2-yl-diphenylsilane
CID 164757098
(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,5,6-tetradeuterio-4-[6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-[1]benzothiolo[3,2-a]carbazol-12-yl]phenyl]-[2,3,4,6-tetradeuterio-5-(2,3,4,5,6-pentadeuteriophenyl)phenyl]silane
CID 176802991
triphenyl-[4-[4-[2,3,4,6-tetradeuterio-5-(1,2,3,6,7,8,9-heptadeuteriodibenzofuran-4-yl)phenyl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane
CID 176722325

Frequently Asked Questions

What is the IUPAC name of dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane?
The IUPAC name of dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane (CID 177070079) is dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane.
What is the SMILES notation for dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane?
The canonical SMILES for dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane is [2H]c1c([2H])c([2H])c(-n2c3ccccc3c3c([2H])c([2H])c4c(c5c([2H])c([2H])c([2H])c([2H])c5n4-c4nc(-c5c([2H])c([2H])c([2H])c([Si](c6ccccc6)(c6ccc7oc8ccccc8c7c6)c6c([2H])c([2H])c([2H])c([2H])c6[2H])c5[2H])nc(-c5c([2H])c([2H])c([2H])c([2H])c5-n5c6c([2H])c([2H])c([2H])c([2H])c6c6c([2H])c([2H])c([2H])c([2H])c65)n4)c32)c([2H])c1[2H].
What is the InChIKey of dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane?
The InChIKey is NDNHVWSDYZFJSD-DMOLUDBTSA-N. The full InChI is InChI=1S/C75H48N6OSi/c1-4-24-50(25-5-1)79-63-37-16-12-33-57(63)59-44-45-68-71(72(59)79)60-35-13-19-40-66(60)81(68)75-77-73(76-74(78-75)61-36-14-20-41-67(61)80-64-38-17-10-31-55(64)56-32-11-18-39-65(56)80)49-23-22-30-53(47-49)83(51-26-6-2-7-27-51,52-28-8-3-9-29-52)54-43-46-70-62(48-54)58-34-15-21-42-69(58)82-70/h1-48H/i1D,2D,4D,5D,6D,7D,10D,11D,13D,14D,17D,18D,19D,20D,22D,23D,24D,25D,26D,27D,30D,31D,32D,35D,36D,38D,39D,40D,41D,44D,45D,47D.
What are the key properties of dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane?
dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane has a molecular weight of 1109.53 g/mol, XLogP of 15.77, 9 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzofuran-2-yl-(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[4-[1,2,3,4,6,7-hexadeuterio-12-(2,3,4,5,6-pentadeuteriophenyl)indolo[3,2-c]carbazol-5-yl]-6-[2,3,4,5-tetradeuterio-6-(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]silane is sourced from PubChem (CID 177070079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).