[3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane

C158H113N13Si3 — CID 165107505

IUPAC[3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane
SMILES[2H]c1c([2H])c([2H])c([Si](c2c([2H])c([2H])c([2H])c([2H])c2[2H])(c2c([2H])c([2H])c(C)c([2H])c2[2H])c2c([2H])c([2H])c([2H])c(-c3cc(-n4c5c([2H])c([2H])c([2H])c([2H])c5c5c([2H])c([2H])c([2H])c([2H])c54)nc(-n4c5c([2H])c([2H])c([2H])c([2H])c5c5c([2H])c([2H])c([2H])c([2H])c54)c3)c2[2H])c([2H])c1[2H].[2H]c1c([2H])c([2H])c([Si](c2c([2H])c([2H])c([2H])c([2H])c2[2H])(c2c([2H])c([2H])c(C)c([2H])c2[2H])c2c([2H])c([2H])c([2H])c(-c3nc(-n4c5c([2H])c([2H])c([2H])c([2H])c5c5c([2H])c([2H])c([2H])c([2H])c54)nc(-n4c5c([2H])c([2H])c([2H])c([2H])c5c5c([2H])c([2H])c([2H])c([2H])c54)n3)c2[2H])c([2H])c1[2H].[2H]c1c([2H])c([2H])c([Si](c2c([2H])c([2H])c([2H])c([2H])c2[2H])(c2c([2H])c([2H])c([2H])c(C)c2[2H])c2c([2H])c([2H])c([2H])c(-c3nc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c2[2H])c([2H])c1[2H]
InChIInChI=1S/C54H39N3Si.2C52H37N5Si/c1-38-31-33-43(34-32-38)58(41-18-4-2-5-19-41,42-20-6-3-7-21-42)44-22-16-17-39(35-44)40-36-53(56-49-27-12-8-23-45(49)46-24-9-13-28-50(46)56)55-54(37-40)57-51-29-14-10-25-47(51)48-26-11-15-30-52(48)57;1-36-18-16-24-40(34-36)58(38-20-4-2-5-21-38,39-22-6-3-7-23-39)41-25-17-19-37(35-41)50-53-51(56-46-30-12-8-26-42(46)43-27-9-13-31-47(43)56)55-52(54-50)57-48-32-14-10-28-44(48)45-29-11-15-33-49(45)57;1-36-31-33-40(34-32-36)58(38-18-4-2-5-19-38,39-20-6-3-7-21-39)41-22-16-17-37(35-41)50-53-51(56-46-27-12-8-23-42(46)43-24-9-13-28-47(43)56)55-52(54-50)57-48-29-14-10-25-44(48)45-26-11-15-30-49(45)57/h2-37H,1H3;2*2-35H,1H3/i2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D,27D,28D,29D,30D,31D,32D,33D,34D,35D;2D,3D,4D,5D,6D,7D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,34D,35D;2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D,27D,28D,29D,30D,31D,32D,33D,34D,35D
InChIKeyZJTLVXJLPRODNI-FNACGOROSA-N
MW2364.52 g/mol
LogP29.47
Rot. Bonds21

About [3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane

[3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane (PubChem CID 165107505) has the molecular formula C158H113N13Si3 and a molecular weight of 2364.52 g/mol. Its IUPAC name is [3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane.

Molecular Properties

Compound Name[3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane
PubChem CID165107505
Molecular FormulaC158H113N13Si3
Molecular Weight2364.52 g/mol
Exact Mass2362.39
IUPAC Name[3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane
SMILES[2H]c1c([2H])c([2H])c([Si](c2c([2H])c([2H])c([2H])c([2H])c2[2H])(c2c([2H])c([2H])c(C)c([2H])c2[2H])c2c([2H])c([2H])c([2H])c(-c3cc(-n4c5c([2H])c([2H])c([2H])c([2H])c5c5c([2H])c([2H])c([2H])c([2H])c54)nc(-n4c5c([2H])c([2H])c([2H])c([2H])c5c5c([2H])c([2H])c([2H])c([2H])c54)c3)c2[2H])c([2H])c1[2H].[2H]c1c([2H])c([2H])c([Si](c2c([2H])c([2H])c([2H])c([2H])c2[2H])(c2c([2H])c([2H])c(C)c([2H])c2[2H])c2c([2H])c([2H])c([2H])c(-c3nc(-n4c5c([2H])c([2H])c([2H])c([2H])c5c5c([2H])c([2H])c([2H])c([2H])c54)nc(-n4c5c([2H])c([2H])c([2H])c([2H])c5c5c([2H])c([2H])c([2H])c([2H])c54)n3)c2[2H])c([2H])c1[2H].[2H]c1c([2H])c([2H])c([Si](c2c([2H])c([2H])c([2H])c([2H])c2[2H])(c2c([2H])c([2H])c([2H])c(C)c2[2H])c2c([2H])c([2H])c([2H])c(-c3nc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c2[2H])c([2H])c1[2H]
InChIInChI=1S/C54H39N3Si.2C52H37N5Si/c1-38-31-33-43(34-32-38)58(41-18-4-2-5-19-41,42-20-6-3-7-21-42)44-22-16-17-39(35-44)40-36-53(56-49-27-12-8-23-45(49)46-24-9-13-28-50(46)56)55-54(37-40)57-51-29-14-10-25-47(51)48-26-11-15-30-52(48)57;1-36-18-16-24-40(34-36)58(38-20-4-2-5-21-38,39-22-6-3-7-23-39)41-25-17-19-37(35-41)50-53-51(56-46-30-12-8-26-42(46)43-27-9-13-31-47(43)56)55-52(54-50)57-48-32-14-10-28-44(48)45-29-11-15-33-49(45)57;1-36-31-33-40(34-32-36)58(38-18-4-2-5-19-38,39-20-6-3-7-21-39)41-22-16-17-37(35-41)50-53-51(56-46-27-12-8-23-42(46)43-24-9-13-28-47(43)56)55-52(54-50)57-48-29-14-10-25-44(48)45-26-11-15-30-49(45)57/h2-37H,1H3;2*2-35H,1H3/i2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D,27D,28D,29D,30D,31D,32D,33D,34D,35D;2D,3D,4D,5D,6D,7D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,34D,35D;2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D,27D,28D,29D,30D,31D,32D,33D,34D,35D
InChIKeyZJTLVXJLPRODNI-FNACGOROSA-N
XLogP29.47
TPSA119.81 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds21
Heavy Atoms174
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002364.52
LogP ≤ 529.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Analyze [3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane with MolForge

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Related Compounds

bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[3,5-dideuterio-2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]phenyl]-(2,3,5,6-tetradeuterio-4-methylphenyl)silane
CID 165035122
(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-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-(3-methylphenyl)-phenyl-[2,3,4,6-tetradeuterio-5-(trideuteriomethyl)phenyl]silane
CID 176751578
[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
bis(2,3,4,5,6-pentadeuteriophenyl)-phenyl-[2,3,4,6-tetradeuterio-5-[5-deuterio-2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)pyrimidin-4-yl]phenyl]silane
CID 164843238
[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,6-trideuterio-5-tris(2,3,4,5,6-pentadeuteriophenyl)silylphenyl]-tris(2,3,4,5,6-pentadeuteriophenyl)silane
CID 168800210
[3-[4,6-bis(3,6-dideuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-triphenylsilane
CID 169052835
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
[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-[3-(2,3,4,5,6-pentadeuteriophenyl)phenyl]-phenyl-[2,3,4,5-tetradeuterio-6-(trideuteriomethyl)phenyl]silane
CID 176751583
[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-phenylsilane
CID 164843272
(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
20-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)-3,4,5,6,9,10,11,12,15,16,17,18,22,23,24,25-hexadecadeuterio-20-azapentacyclo[19.4.0.02,7.08,13.014,19]pentacosa-1(25),2,4,6,8,10,12,14,16,18,21,23-dodecaene
CID 177285032

Frequently Asked Questions

What is the IUPAC name of [3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane?
The IUPAC name of [3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane (CID 165107505) is [3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane.
What is the SMILES notation for [3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane?
The canonical SMILES for [3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane is [2H]c1c([2H])c([2H])c([Si](c2c([2H])c([2H])c([2H])c([2H])c2[2H])(c2c([2H])c([2H])c(C)c([2H])c2[2H])c2c([2H])c([2H])c([2H])c(-c3cc(-n4c5c([2H])c([2H])c([2H])c([2H])c5c5c([2H])c([2H])c([2H])c([2H])c54)nc(-n4c5c([2H])c([2H])c([2H])c([2H])c5c5c([2H])c([2H])c([2H])c([2H])c54)c3)c2[2H])c([2H])c1[2H].[2H]c1c([2H])c([2H])c([Si](c2c([2H])c([2H])c([2H])c([2H])c2[2H])(c2c([2H])c([2H])c(C)c([2H])c2[2H])c2c([2H])c([2H])c([2H])c(-c3nc(-n4c5c([2H])c([2H])c([2H])c([2H])c5c5c([2H])c([2H])c([2H])c([2H])c54)nc(-n4c5c([2H])c([2H])c([2H])c([2H])c5c5c([2H])c([2H])c([2H])c([2H])c54)n3)c2[2H])c([2H])c1[2H].[2H]c1c([2H])c([2H])c([Si](c2c([2H])c([2H])c([2H])c([2H])c2[2H])(c2c([2H])c([2H])c([2H])c(C)c2[2H])c2c([2H])c([2H])c([2H])c(-c3nc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c2[2H])c([2H])c1[2H].
What is the InChIKey of [3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane?
The InChIKey is ZJTLVXJLPRODNI-FNACGOROSA-N. The full InChI is InChI=1S/C54H39N3Si.2C52H37N5Si/c1-38-31-33-43(34-32-38)58(41-18-4-2-5-19-41,42-20-6-3-7-21-42)44-22-16-17-39(35-44)40-36-53(56-49-27-12-8-23-45(49)46-24-9-13-28-50(46)56)55-54(37-40)57-51-29-14-10-25-47(51)48-26-11-15-30-52(48)57;1-36-18-16-24-40(34-36)58(38-20-4-2-5-21-38,39-22-6-3-7-23-39)41-25-17-19-37(35-41)50-53-51(56-46-30-12-8-26-42(46)43-27-9-13-31-47(43)56)55-52(54-50)57-48-32-14-10-28-44(48)45-29-11-15-33-49(45)57;1-36-31-33-40(34-32-36)58(38-18-4-2-5-19-38,39-20-6-3-7-21-39)41-22-16-17-37(35-41)50-53-51(56-46-27-12-8-23-42(46)43-24-9-13-28-47(43)56)55-52(54-50)57-48-29-14-10-25-44(48)45-26-11-15-30-49(45)57/h2-37H,1H3;2*2-35H,1H3/i2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D,27D,28D,29D,30D,31D,32D,33D,34D,35D;2D,3D,4D,5D,6D,7D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,34D,35D;2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D,27D,28D,29D,30D,31D,32D,33D,34D,35D.
What are the key properties of [3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane?
[3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane has a molecular weight of 2364.52 g/mol, XLogP of 29.47, 21 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[2,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-4-pyridinyl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;[3-[4,6-bis(1,2,3,4,5,6,7,8-octadeuteriocarbazol-9-yl)-1,3,5-triazin-2-yl]-2,4,5,6-tetradeuteriophenyl]-bis(2,3,4,5,6-pentadeuteriophenyl)-(2,3,5,6-tetradeuterio-4-methylphenyl)silane;bis(2,3,4,5,6-pentadeuteriophenyl)-[2,3,4,6-tetradeuterio-5-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-(2,3,4,6-tetradeuterio-5-methylphenyl)silane is sourced from PubChem (CID 165107505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).