8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine

C278H206N16O8Si2 — CID 161408724

IUPAC8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine
SMILESCC(C)(C)c1ccc(N(c2ccccc2)c2cc3c(c4oc(-c5ccccc5)nc24)-c2c(cc(N(c4ccccc4)c4ccc(C(C)(C)C)cc4)c4nc(-c5ccccc5)oc24)C32c3ccccc3-c3ccccc32)cc1.C[Si](C)(C)c1ccc(N(c2ccccc2)c2cc3c(c4oc(-c5ccccc5)nc24)-c2c(cc(N(c4ccccc4)c4ccc([Si](C)(C)C)cc4)c4nc(-c5ccccc5)oc24)C32c3ccccc3-c3ccccc32)cc1.Cc1cccc(N(c2ccccc2)c2cc3c(c4oc(-c5ccccc5)nc24)-c2c(cc(N(c4ccccc4)c4cccc(C)c4)c4nc(-c5ccccc5)oc24)C32c3ccccc3-c3ccccc32)c1.Cc1ccccc1-c1nc2c(N(c3ccccc3)c3ccc4ccccc4c3)cc3c(c2o1)-c1c(cc(N(c2ccccc2)c2ccc4ccccc4c2)c2nc(-c4ccccc4C)oc12)C3(c1ccccc1)c1ccccc1
InChIInChI=1S/C73H50N4O2.C71H56N4O2.C69H56N4O2Si2.C65H44N4O2/c1-47-23-15-21-37-59(47)71-74-67-63(76(55-33-11-5-12-34-55)57-41-39-49-25-17-19-27-51(49)43-57)45-61-65(69(67)78-71)66-62(73(61,53-29-7-3-8-30-53)54-31-9-4-10-32-54)46-64(68-70(66)79-72(75-68)60-38-22-16-24-48(60)2)77(56-35-13-6-14-36-56)58-42-40-50-26-18-20-28-52(50)44-58;1-69(2,3)47-35-39-51(40-36-47)74(49-27-15-9-16-28-49)59-43-57-61(65-63(59)72-67(76-65)45-23-11-7-12-24-45)62-58(71(57)55-33-21-19-31-53(55)54-32-20-22-34-56(54)71)44-60(64-66(62)77-68(73-64)46-25-13-8-14-26-46)75(50-29-17-10-18-30-50)52-41-37-48(38-42-52)70(4,5)6;1-76(2,3)51-39-35-49(36-40-51)72(47-27-15-9-16-28-47)59-43-57-61(65-63(59)70-67(74-65)45-23-11-7-12-24-45)62-58(69(57)55-33-21-19-31-53(55)54-32-20-22-34-56(54)69)44-60(64-66(62)75-68(71-64)46-25-13-8-14-26-46)73(48-29-17-10-18-30-48)50-37-41-52(42-38-50)77(4,5)6;1-41-21-19-31-47(37-41)68(45-27-11-5-12-28-45)55-39-53-57(61-59(55)66-63(70-61)43-23-7-3-8-24-43)58-54(65(53)51-35-17-15-33-49(51)50-34-16-18-36-52(50)65)40-56(60-62(58)71-64(67-60)44-25-9-4-10-26-44)69(46-29-13-6-14-30-46)48-32-20-22-42(2)38-48/h3-46H,1-2H3;2*7-44H,1-6H3;3-40H,1-2H3
InChIKeyVVEOSGLBFUJGLN-UHFFFAOYSA-N
MW3954.98 g/mol
LogP73.59
Rot. Bonds36

About 8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine

8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine (PubChem CID 161408724) has the molecular formula C278H206N16O8Si2 and a molecular weight of 3954.98 g/mol. Its IUPAC name is 8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine.

Molecular Properties

Compound Name8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine
PubChem CID161408724
Molecular FormulaC278H206N16O8Si2
Molecular Weight3954.98 g/mol
Exact Mass3951.57
IUPAC Name8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine
SMILESCC(C)(C)c1ccc(N(c2ccccc2)c2cc3c(c4oc(-c5ccccc5)nc24)-c2c(cc(N(c4ccccc4)c4ccc(C(C)(C)C)cc4)c4nc(-c5ccccc5)oc24)C32c3ccccc3-c3ccccc32)cc1.C[Si](C)(C)c1ccc(N(c2ccccc2)c2cc3c(c4oc(-c5ccccc5)nc24)-c2c(cc(N(c4ccccc4)c4ccc([Si](C)(C)C)cc4)c4nc(-c5ccccc5)oc24)C32c3ccccc3-c3ccccc32)cc1.Cc1cccc(N(c2ccccc2)c2cc3c(c4oc(-c5ccccc5)nc24)-c2c(cc(N(c4ccccc4)c4cccc(C)c4)c4nc(-c5ccccc5)oc24)C32c3ccccc3-c3ccccc32)c1.Cc1ccccc1-c1nc2c(N(c3ccccc3)c3ccc4ccccc4c3)cc3c(c2o1)-c1c(cc(N(c2ccccc2)c2ccc4ccccc4c2)c2nc(-c4ccccc4C)oc12)C3(c1ccccc1)c1ccccc1
InChIInChI=1S/C73H50N4O2.C71H56N4O2.C69H56N4O2Si2.C65H44N4O2/c1-47-23-15-21-37-59(47)71-74-67-63(76(55-33-11-5-12-34-55)57-41-39-49-25-17-19-27-51(49)43-57)45-61-65(69(67)78-71)66-62(73(61,53-29-7-3-8-30-53)54-31-9-4-10-32-54)46-64(68-70(66)79-72(75-68)60-38-22-16-24-48(60)2)77(56-35-13-6-14-36-56)58-42-40-50-26-18-20-28-52(50)44-58;1-69(2,3)47-35-39-51(40-36-47)74(49-27-15-9-16-28-49)59-43-57-61(65-63(59)72-67(76-65)45-23-11-7-12-24-45)62-58(71(57)55-33-21-19-31-53(55)54-32-20-22-34-56(54)71)44-60(64-66(62)77-68(73-64)46-25-13-8-14-26-46)75(50-29-17-10-18-30-50)52-41-37-48(38-42-52)70(4,5)6;1-76(2,3)51-39-35-49(36-40-51)72(47-27-15-9-16-28-47)59-43-57-61(65-63(59)70-67(74-65)45-23-11-7-12-24-45)62-58(69(57)55-33-21-19-31-53(55)54-32-20-22-34-56(54)69)44-60(64-66(62)75-68(71-64)46-25-13-8-14-26-46)73(48-29-17-10-18-30-48)50-37-41-52(42-38-50)77(4,5)6;1-41-21-19-31-47(37-41)68(45-27-11-5-12-28-45)55-39-53-57(61-59(55)66-63(70-61)43-23-7-3-8-24-43)58-54(65(53)51-35-17-15-33-49(51)50-34-16-18-36-52(50)65)40-56(60-62(58)71-64(67-60)44-25-9-4-10-26-44)69(46-29-13-6-14-30-46)48-32-20-22-42(2)38-48/h3-46H,1-2H3;2*7-44H,1-6H3;3-40H,1-2H3
InChIKeyVVEOSGLBFUJGLN-UHFFFAOYSA-N
XLogP73.59
TPSA234.16 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds36
Heavy Atoms304
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003954.98
LogP ≤ 573.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine?
The IUPAC name of 8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine (CID 161408724) is 8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine.
What is the SMILES notation for 8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine?
The canonical SMILES for 8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine is CC(C)(C)c1ccc(N(c2ccccc2)c2cc3c(c4oc(-c5ccccc5)nc24)-c2c(cc(N(c4ccccc4)c4ccc(C(C)(C)C)cc4)c4nc(-c5ccccc5)oc24)C32c3ccccc3-c3ccccc32)cc1.C[Si](C)(C)c1ccc(N(c2ccccc2)c2cc3c(c4oc(-c5ccccc5)nc24)-c2c(cc(N(c4ccccc4)c4ccc([Si](C)(C)C)cc4)c4nc(-c5ccccc5)oc24)C32c3ccccc3-c3ccccc32)cc1.Cc1cccc(N(c2ccccc2)c2cc3c(c4oc(-c5ccccc5)nc24)-c2c(cc(N(c4ccccc4)c4cccc(C)c4)c4nc(-c5ccccc5)oc24)C32c3ccccc3-c3ccccc32)c1.Cc1ccccc1-c1nc2c(N(c3ccccc3)c3ccc4ccccc4c3)cc3c(c2o1)-c1c(cc(N(c2ccccc2)c2ccc4ccccc4c2)c2nc(-c4ccccc4C)oc12)C3(c1ccccc1)c1ccccc1.
What is the InChIKey of 8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine?
The InChIKey is VVEOSGLBFUJGLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C73H50N4O2.C71H56N4O2.C69H56N4O2Si2.C65H44N4O2/c1-47-23-15-21-37-59(47)71-74-67-63(76(55-33-11-5-12-34-55)57-41-39-49-25-17-19-27-51(49)43-57)45-61-65(69(67)78-71)66-62(73(61,53-29-7-3-8-30-53)54-31-9-4-10-32-54)46-64(68-70(66)79-72(75-68)60-38-22-16-24-48(60)2)77(56-35-13-6-14-36-56)58-42-40-50-26-18-20-28-52(50)44-58;1-69(2,3)47-35-39-51(40-36-47)74(49-27-15-9-16-28-49)59-43-57-61(65-63(59)72-67(76-65)45-23-11-7-12-24-45)62-58(71(57)55-33-21-19-31-53(55)54-32-20-22-34-56(54)71)44-60(64-66(62)77-68(73-64)46-25-13-8-14-26-46)75(50-29-17-10-18-30-50)52-41-37-48(38-42-52)70(4,5)6;1-76(2,3)51-39-35-49(36-40-51)72(47-27-15-9-16-28-47)59-43-57-61(65-63(59)70-67(74-65)45-23-11-7-12-24-45)62-58(69(57)55-33-21-19-31-53(55)54-32-20-22-34-56(54)69)44-60(64-66(62)75-68(71-64)46-25-13-8-14-26-46)73(48-29-17-10-18-30-48)50-37-41-52(42-38-50)77(4,5)6;1-41-21-19-31-47(37-41)68(45-27-11-5-12-28-45)55-39-53-57(61-59(55)66-63(70-61)43-23-7-3-8-24-43)58-54(65(53)51-35-17-15-33-49(51)50-34-16-18-36-52(50)65)40-56(60-62(58)71-64(67-60)44-25-9-4-10-26-44)69(46-29-13-6-14-30-46)48-32-20-22-42(2)38-48/h3-46H,1-2H3;2*7-44H,1-6H3;3-40H,1-2H3.
What are the key properties of 8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine?
8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine has a molecular weight of 3954.98 g/mol, XLogP of 73.59, 36 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 8-N,14-N-bis(4-tert-butylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;5,17-bis(2-methylphenyl)-8-N,14-N-dinaphthalen-2-yl-8-N,14-N,11,11-tetraphenyl-4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-8,14-diamine;8-N,14-N-bis(3-methylphenyl)-8-N,14-N,5,17-tetraphenylspiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine;8-N,14-N,5,17-tetraphenyl-8-N,14-N-bis(4-trimethylsilylphenyl)spiro[4,18-dioxa-6,16-diazapentacyclo[10.7.0.02,10.03,7.015,19]nonadeca-1(19),2,5,7,9,12,14,16-octaene-11,9'-fluorene]-8,14-diamine is sourced from PubChem (CID 161408724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).