1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine

C290H248F8N8Si6 — CID 160536243

IUPAC1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine
SMILES[2H]c1c([2H])c([2H])c(-c2cc(F)c(N(c3ccc([Si](C)(C)C)cc3)c3ccc4ccc5c(N(c6ccc([Si](C)(C)C)cc6)c6c(F)cc(-c7c([2H])c([2H])c([2H])c([2H])c7[2H])cc6-c6c([2H])c([2H])c([2H])c([2H])c6[2H])ccc6ccc3c4c65)c(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2cc(F)c(N(c3cccc([Si](C)(C)C)c3)c3ccc4ccc5c(N(c6cccc([Si](C)(C)C)c6)c6c(F)cc(-c7c([2H])c([2H])c([2H])c([2H])c7[2H])cc6-c6c([2H])c([2H])c([2H])c([2H])c6[2H])ccc6ccc3c4c65)c(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2cc(F)c(N(c3ccccc3[Si](C)(C)C)c3ccc4ccc5c(N(c6ccccc6[Si](C)(C)C)c6c(F)cc(-c7c([2H])c([2H])c([2H])c([2H])c7[2H])cc6-c6c([2H])c([2H])c([2H])c([2H])c6[2H])ccc6ccc3c4c65)c(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(N(c2c(F)ccc(-c3ccc(C(C)(C)C)cc3)c2-c2ccc(C(C)(C)C)cc2)c2ccc3ccc4c(N(c5c([2H])c([2H])c([2H])c([2H])c5[2H])c5c(F)ccc(-c6ccc(C(C)(C)C)cc6)c5-c5ccc(C(C)(C)C)cc5)ccc5ccc2c3c54)c([2H])c1[2H]
InChIInChI=1S/C80H74F2N2.3C70H58F2N2Si2/c1-77(2,3)57-35-23-51(24-36-57)63-45-47-67(81)75(73(63)55-27-39-59(40-28-55)79(7,8)9)83(61-19-15-13-16-20-61)69-49-33-53-32-44-66-70(50-34-54-31-43-65(69)71(53)72(54)66)84(62-21-17-14-18-22-62)76-68(82)48-46-64(52-25-37-58(38-26-52)78(4,5)6)74(76)56-29-41-60(42-30-56)80(10,11)12;1-75(2,3)65-33-21-19-31-63(65)73(69-57(49-27-15-9-16-28-49)43-53(45-59(69)71)47-23-11-7-12-24-47)61-41-37-51-36-40-56-62(42-38-52-35-39-55(61)67(51)68(52)56)74(64-32-20-22-34-66(64)76(4,5)6)70-58(50-29-17-10-18-30-50)44-54(46-60(70)72)48-25-13-8-14-26-48;1-75(2,3)57-31-19-29-55(45-57)73(69-61(49-25-15-9-16-26-49)41-53(43-63(69)71)47-21-11-7-12-22-47)65-39-35-51-34-38-60-66(40-36-52-33-37-59(65)67(51)68(52)60)74(56-30-20-32-58(46-56)76(4,5)6)70-62(50-27-17-10-18-28-50)42-54(44-64(70)72)48-23-13-8-14-24-48;1-75(2,3)57-35-31-55(32-36-57)73(69-61(49-23-15-9-16-24-49)43-53(45-63(69)71)47-19-11-7-12-20-47)65-41-29-51-28-40-60-66(42-30-52-27-39-59(65)67(51)68(52)60)74(56-33-37-58(38-34-56)76(4,5)6)70-62(50-25-17-10-18-26-50)44-54(46-64(70)72)48-21-13-8-14-22-48/h13-50H,1-12H3;3*7-46H,1-6H3/i13D,14D,15D,16D,17D,18D,19D,20D,21D,22D;7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,23D,24D,25D,26D,27D,28D,29D,30D;7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,21D,22D,23D,24D,25D,26D,27D,28D;7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D
InChIKeyQWEUEQPRLQQTTP-DRPGAXBVSA-N
MW4236.16 g/mol
LogP82.34
Rot. Bonds46

About 1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine

1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine (PubChem CID 160536243) has the molecular formula C290H248F8N8Si6 and a molecular weight of 4236.16 g/mol. Its IUPAC name is 1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine.

Molecular Properties

Compound Name1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine
PubChem CID160536243
Molecular FormulaC290H248F8N8Si6
Molecular Weight4236.16 g/mol
Exact Mass4232.25
IUPAC Name1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine
SMILES[2H]c1c([2H])c([2H])c(-c2cc(F)c(N(c3ccc([Si](C)(C)C)cc3)c3ccc4ccc5c(N(c6ccc([Si](C)(C)C)cc6)c6c(F)cc(-c7c([2H])c([2H])c([2H])c([2H])c7[2H])cc6-c6c([2H])c([2H])c([2H])c([2H])c6[2H])ccc6ccc3c4c65)c(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2cc(F)c(N(c3cccc([Si](C)(C)C)c3)c3ccc4ccc5c(N(c6cccc([Si](C)(C)C)c6)c6c(F)cc(-c7c([2H])c([2H])c([2H])c([2H])c7[2H])cc6-c6c([2H])c([2H])c([2H])c([2H])c6[2H])ccc6ccc3c4c65)c(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2cc(F)c(N(c3ccccc3[Si](C)(C)C)c3ccc4ccc5c(N(c6ccccc6[Si](C)(C)C)c6c(F)cc(-c7c([2H])c([2H])c([2H])c([2H])c7[2H])cc6-c6c([2H])c([2H])c([2H])c([2H])c6[2H])ccc6ccc3c4c65)c(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(N(c2c(F)ccc(-c3ccc(C(C)(C)C)cc3)c2-c2ccc(C(C)(C)C)cc2)c2ccc3ccc4c(N(c5c([2H])c([2H])c([2H])c([2H])c5[2H])c5c(F)ccc(-c6ccc(C(C)(C)C)cc6)c5-c5ccc(C(C)(C)C)cc5)ccc5ccc2c3c54)c([2H])c1[2H]
InChIInChI=1S/C80H74F2N2.3C70H58F2N2Si2/c1-77(2,3)57-35-23-51(24-36-57)63-45-47-67(81)75(73(63)55-27-39-59(40-28-55)79(7,8)9)83(61-19-15-13-16-20-61)69-49-33-53-32-44-66-70(50-34-54-31-43-65(69)71(53)72(54)66)84(62-21-17-14-18-22-62)76-68(82)48-46-64(52-25-37-58(38-26-52)78(4,5)6)74(76)56-29-41-60(42-30-56)80(10,11)12;1-75(2,3)65-33-21-19-31-63(65)73(69-57(49-27-15-9-16-28-49)43-53(45-59(69)71)47-23-11-7-12-24-47)61-41-37-51-36-40-56-62(42-38-52-35-39-55(61)67(51)68(52)56)74(64-32-20-22-34-66(64)76(4,5)6)70-58(50-29-17-10-18-30-50)44-54(46-60(70)72)48-25-13-8-14-26-48;1-75(2,3)57-31-19-29-55(45-57)73(69-61(49-25-15-9-16-26-49)41-53(43-63(69)71)47-21-11-7-12-22-47)65-39-35-51-34-38-60-66(40-36-52-33-37-59(65)67(51)68(52)60)74(56-30-20-32-58(46-56)76(4,5)6)70-62(50-27-17-10-18-28-50)42-54(44-64(70)72)48-23-13-8-14-24-48;1-75(2,3)57-35-31-55(32-36-57)73(69-61(49-23-15-9-16-24-49)43-53(45-63(69)71)47-19-11-7-12-20-47)65-41-29-51-28-40-60-66(42-30-52-27-39-59(65)67(51)68(52)60)74(56-33-37-58(38-34-56)76(4,5)6)70-62(50-25-17-10-18-26-50)44-54(46-64(70)72)48-21-13-8-14-22-48/h13-50H,1-12H3;3*7-46H,1-6H3/i13D,14D,15D,16D,17D,18D,19D,20D,21D,22D;7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,23D,24D,25D,26D,27D,28D,29D,30D;7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,21D,22D,23D,24D,25D,26D,27D,28D;7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D
InChIKeyQWEUEQPRLQQTTP-DRPGAXBVSA-N
XLogP82.34
TPSA25.92 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds46
Heavy Atoms312
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5004236.16
LogP ≤ 582.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine with MolForge

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Related Compounds

1-N,6-N-bis[2-fluoro-4,6-bis(4-trimethylsilylphenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine
CID 59357649
1-N,6-N-bis(2-tert-butylphenyl)-1-N,6-N-bis[2-fluoro-4,6-bis(4-trimethylsilylphenyl)phenyl]pyrene-1,6-diamine
CID 59357783
1-N,6-N-bis[2-fluoro-4,6-bis(4-trimethylsilylphenyl)phenyl]-1-N,6-N-bis(3-methylphenyl)pyrene-1,6-diamine
CID 59357685
1-N,6-N-bis[2,4-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-dinaphthalen-1-ylpyrene-1,6-diamine
CID 59357909
1-N,6-N-bis[2-fluoro-4,6-bis(4-trimethylsilylphenyl)phenyl]-1-N,6-N-bis(2-phenylphenyl)pyrene-1,6-diamine
CID 59357645
1-N,6-N-bis(2-tert-butylphenyl)-1-N,6-N-bis(2-fluoro-4,6-diphenylphenyl)pyrene-1,6-diamine;1-N,6-N-bis(3-tert-butylphenyl)-1-N,6-N-bis(2-fluoro-4,6-diphenylphenyl)pyrene-1,6-diamine
CID 158390523
1-N,5-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,5-N-dinaphthalen-2-ylpyrene-1,5-diamine
CID 59357780
3-[N-[6-(N-[2,4-bis(4-tert-butylphenyl)-6-fluorophenyl]-3-cyanoanilino)pyren-1-yl]-2,4-bis(4-tert-butylphenyl)-6-fluoroanilino]benzonitrile
CID 59358046
1-N,6-N-bis[2,4-bis(3-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-diphenylpyrene-1,6-diamine
CID 59357618
2-[N-[6-(2-cyano-N-[2-fluoro-4,6-bis(4-trimethylsilylphenyl)phenyl]anilino)pyren-1-yl]-2-fluoro-4,6-bis(4-trimethylsilylphenyl)anilino]benzonitrile
CID 90429425
1-N,6-N-bis[6-fluoro-2,3-bis(2-methylphenyl)phenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis(6-fluoro-2,3-diphenylphenyl)-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine
CID 159022545
5-N,18-N-bis(4-tert-butylphenyl)-5-N,18-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-21,21-diphenylpentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaene-5,18-diamine;5-N,18-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-5-N,18-N-bis(2,3,4,5,6-pentadeuteriophenyl)-21,21-diphenylpentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2(7),3,5,8,10,12,15(20),16,18-decaene-5,18-diamine
CID 160911995

Frequently Asked Questions

What is the IUPAC name of 1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine?
The IUPAC name of 1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine (CID 160536243) is 1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine.
What is the SMILES notation for 1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine?
The canonical SMILES for 1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine is [2H]c1c([2H])c([2H])c(-c2cc(F)c(N(c3ccc([Si](C)(C)C)cc3)c3ccc4ccc5c(N(c6ccc([Si](C)(C)C)cc6)c6c(F)cc(-c7c([2H])c([2H])c([2H])c([2H])c7[2H])cc6-c6c([2H])c([2H])c([2H])c([2H])c6[2H])ccc6ccc3c4c65)c(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2cc(F)c(N(c3cccc([Si](C)(C)C)c3)c3ccc4ccc5c(N(c6cccc([Si](C)(C)C)c6)c6c(F)cc(-c7c([2H])c([2H])c([2H])c([2H])c7[2H])cc6-c6c([2H])c([2H])c([2H])c([2H])c6[2H])ccc6ccc3c4c65)c(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(-c2cc(F)c(N(c3ccccc3[Si](C)(C)C)c3ccc4ccc5c(N(c6ccccc6[Si](C)(C)C)c6c(F)cc(-c7c([2H])c([2H])c([2H])c([2H])c7[2H])cc6-c6c([2H])c([2H])c([2H])c([2H])c6[2H])ccc6ccc3c4c65)c(-c3c([2H])c([2H])c([2H])c([2H])c3[2H])c2)c([2H])c1[2H].[2H]c1c([2H])c([2H])c(N(c2c(F)ccc(-c3ccc(C(C)(C)C)cc3)c2-c2ccc(C(C)(C)C)cc2)c2ccc3ccc4c(N(c5c([2H])c([2H])c([2H])c([2H])c5[2H])c5c(F)ccc(-c6ccc(C(C)(C)C)cc6)c5-c5ccc(C(C)(C)C)cc5)ccc5ccc2c3c54)c([2H])c1[2H].
What is the InChIKey of 1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine?
The InChIKey is QWEUEQPRLQQTTP-DRPGAXBVSA-N. The full InChI is InChI=1S/C80H74F2N2.3C70H58F2N2Si2/c1-77(2,3)57-35-23-51(24-36-57)63-45-47-67(81)75(73(63)55-27-39-59(40-28-55)79(7,8)9)83(61-19-15-13-16-20-61)69-49-33-53-32-44-66-70(50-34-54-31-43-65(69)71(53)72(54)66)84(62-21-17-14-18-22-62)76-68(82)48-46-64(52-25-37-58(38-26-52)78(4,5)6)74(76)56-29-41-60(42-30-56)80(10,11)12;1-75(2,3)65-33-21-19-31-63(65)73(69-57(49-27-15-9-16-28-49)43-53(45-59(69)71)47-23-11-7-12-24-47)61-41-37-51-36-40-56-62(42-38-52-35-39-55(61)67(51)68(52)56)74(64-32-20-22-34-66(64)76(4,5)6)70-58(50-29-17-10-18-30-50)44-54(46-60(70)72)48-25-13-8-14-26-48;1-75(2,3)57-31-19-29-55(45-57)73(69-61(49-25-15-9-16-26-49)41-53(43-63(69)71)47-21-11-7-12-22-47)65-39-35-51-34-38-60-66(40-36-52-33-37-59(65)67(51)68(52)60)74(56-30-20-32-58(46-56)76(4,5)6)70-62(50-27-17-10-18-28-50)42-54(44-64(70)72)48-23-13-8-14-24-48;1-75(2,3)57-35-31-55(32-36-57)73(69-61(49-23-15-9-16-24-49)43-53(45-63(69)71)47-19-11-7-12-20-47)65-41-29-51-28-40-60-66(42-30-52-27-39-59(65)67(51)68(52)60)74(56-33-37-58(38-34-56)76(4,5)6)70-62(50-25-17-10-18-26-50)44-54(46-64(70)72)48-21-13-8-14-22-48/h13-50H,1-12H3;3*7-46H,1-6H3/i13D,14D,15D,16D,17D,18D,19D,20D,21D,22D;7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,23D,24D,25D,26D,27D,28D,29D,30D;7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,21D,22D,23D,24D,25D,26D,27D,28D;7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D,19D,20D,21D,22D,23D,24D,25D,26D.
What are the key properties of 1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine?
1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine has a molecular weight of 4236.16 g/mol, XLogP of 82.34, 46 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,6-N-bis[2,3-bis(4-tert-butylphenyl)-6-fluorophenyl]-1-N,6-N-bis(2,3,4,5,6-pentadeuteriophenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(2-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(3-trimethylsilylphenyl)pyrene-1,6-diamine;1-N,6-N-bis[2-fluoro-4,6-bis(2,3,4,5,6-pentadeuteriophenyl)phenyl]-1-N,6-N-bis(4-trimethylsilylphenyl)pyrene-1,6-diamine is sourced from PubChem (CID 160536243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).