N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile

C247H180FN9Si4 — CID 162044881

IUPACN-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile
SMILESCC1(C)c2cccc3ccc4cc(N(c5ccc(-c6ccccc6)cc5)c5ccc6c(c5)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5n6-c5ccccc5)cc1c4c23.CC1(C)c2cccc3ccc4cc(N(c5ccc(C#N)cc5)c5ccc6c(c5)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5n6-c5ccccc5)cc1c4c23.CC1(C)c2cccc3ccc4cc(N(c5ccc(F)cc5)c5ccc6c(c5)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5n6-c5ccccc5)cc1c4c23.CC1(C)c2cccc3ccc4cc(N(c5ccc6ccccc6c5)c5ccc6c(c5)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5n6-c5ccccc5)cc1c4c23
InChIInChI=1S/C65H48N2Si.C63H46N2Si.C60H43N3Si.C59H43FN2Si/c1-65(2)59-30-18-21-47-31-32-48-41-52(43-60(65)64(48)63(47)59)66(50-35-33-46(34-36-50)45-19-8-3-9-20-45)51-37-39-61-57(42-51)58-44-56(38-40-62(58)67(61)49-22-10-4-11-23-49)68(53-24-12-5-13-25-53,54-26-14-6-15-27-54)55-28-16-7-17-29-55;1-63(2)57-29-17-20-44-30-31-46-39-50(41-58(63)62(46)61(44)57)64(48-33-32-43-18-15-16-19-45(43)38-48)49-34-36-59-55(40-49)56-42-54(35-37-60(56)65(59)47-21-7-3-8-22-47)66(51-23-9-4-10-24-51,52-25-11-5-12-26-52)53-27-13-6-14-28-53;1-60(2)54-25-15-16-42-28-29-43-36-47(38-55(60)59(43)58(42)54)62(45-30-26-41(40-61)27-31-45)46-32-34-56-52(37-46)53-39-51(33-35-57(53)63(56)44-17-7-3-8-18-44)64(48-19-9-4-10-20-48,49-21-11-5-12-22-49)50-23-13-6-14-24-50;1-59(2)53-25-15-16-40-26-27-41-36-46(38-54(59)58(41)57(40)53)61(44-30-28-42(60)29-31-44)45-32-34-55-51(37-45)52-39-50(33-35-56(52)62(55)43-17-7-3-8-18-43)63(47-19-9-4-10-20-47,48-21-11-5-12-22-48)49-23-13-6-14-24-49/h3-44H,1-2H3;3-42H,1-2H3;3-39H,1-2H3;3-39H,1-2H3
InChIKeyYXTIQSKBXZHMLR-UHFFFAOYSA-N
MW3405.56 g/mol
LogP53.14
Rot. Bonds33

About N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile

N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile (PubChem CID 162044881) has the molecular formula C247H180FN9Si4 and a molecular weight of 3405.56 g/mol. Its IUPAC name is N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile.

Molecular Properties

Compound NameN-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile
PubChem CID162044881
Molecular FormulaC247H180FN9Si4
Molecular Weight3405.56 g/mol
Exact Mass3402.34
IUPAC NameN-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile
SMILESCC1(C)c2cccc3ccc4cc(N(c5ccc(-c6ccccc6)cc5)c5ccc6c(c5)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5n6-c5ccccc5)cc1c4c23.CC1(C)c2cccc3ccc4cc(N(c5ccc(C#N)cc5)c5ccc6c(c5)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5n6-c5ccccc5)cc1c4c23.CC1(C)c2cccc3ccc4cc(N(c5ccc(F)cc5)c5ccc6c(c5)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5n6-c5ccccc5)cc1c4c23.CC1(C)c2cccc3ccc4cc(N(c5ccc6ccccc6c5)c5ccc6c(c5)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5n6-c5ccccc5)cc1c4c23
InChIInChI=1S/C65H48N2Si.C63H46N2Si.C60H43N3Si.C59H43FN2Si/c1-65(2)59-30-18-21-47-31-32-48-41-52(43-60(65)64(48)63(47)59)66(50-35-33-46(34-36-50)45-19-8-3-9-20-45)51-37-39-61-57(42-51)58-44-56(38-40-62(58)67(61)49-22-10-4-11-23-49)68(53-24-12-5-13-25-53,54-26-14-6-15-27-54)55-28-16-7-17-29-55;1-63(2)57-29-17-20-44-30-31-46-39-50(41-58(63)62(46)61(44)57)64(48-33-32-43-18-15-16-19-45(43)38-48)49-34-36-59-55(40-49)56-42-54(35-37-60(56)65(59)47-21-7-3-8-22-47)66(51-23-9-4-10-24-51,52-25-11-5-12-26-52)53-27-13-6-14-28-53;1-60(2)54-25-15-16-42-28-29-43-36-47(38-55(60)59(43)58(42)54)62(45-30-26-41(40-61)27-31-45)46-32-34-56-52(37-46)53-39-51(33-35-57(53)63(56)44-17-7-3-8-18-44)64(48-19-9-4-10-20-48,49-21-11-5-12-22-49)50-23-13-6-14-24-50;1-59(2)53-25-15-16-40-26-27-41-36-46(38-54(59)58(41)57(40)53)61(44-30-28-42(60)29-31-44)45-32-34-55-51(37-45)52-39-50(33-35-56(52)62(55)43-17-7-3-8-18-43)63(47-19-9-4-10-20-47,48-21-11-5-12-22-48)49-23-13-6-14-24-49/h3-44H,1-2H3;3-42H,1-2H3;3-39H,1-2H3;3-39H,1-2H3
InChIKeyYXTIQSKBXZHMLR-UHFFFAOYSA-N
XLogP53.14
TPSA56.47 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds33
Heavy Atoms261
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003405.56
LogP ≤ 553.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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'}

Analyze N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile with MolForge

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Launch Full Analysis

Related Compounds

N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N,9-diphenyl-6-triphenylsilylcarbazol-3-amine
CID 90306227
9-(4-fluorophenyl)-N-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine
CID 59720545
4-N-naphthalen-2-yl-1-N,1-N-diphenyl-4-N-(9-phenyl-6-triphenylsilylcarbazol-3-yl)benzene-1,4-diamine
CID 59720447
N-naphthalen-2-yl-N,9-diphenyl-6-triphenylsilylcarbazol-3-amine
CID 59720564
N-(4-fluorophenyl)-9-phenyl-N-(9-phenyl-6-triphenylsilylcarbazol-3-yl)-6-triphenylsilylcarbazol-3-amine
CID 59381378
4-(N-[9-(4-fluorophenyl)-6-triphenylsilylcarbazol-3-yl]-4-isocyanoanilino)benzonitrile
CID 88953993
N-(4-methylphenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine
CID 59720567
N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(9,9-dimethyl-7-trimethylsilylfluoren-2-yl)-9-phenylcarbazol-3-amine
CID 90306200
9-(4-fluorophenyl)-N,N-bis(4-methylphenyl)-6-triphenylsilylcarbazol-3-amine
CID 59720504
4-(N-[4-[10-(4-fluorophenyl)-15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8,10,12-heptaenyl]phenyl]anilino)benzonitrile
CID 90307949
N-[9-(4-fluorophenyl)carbazol-3-yl]-N-naphthalen-1-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine
CID 59720498
4-[N-[6-(4-cyano-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]anilino)-9-phenylcarbazol-3-yl]-4-(9,9-dimethylfluoren-2-yl)anilino]benzonitrile
CID 59344006

Frequently Asked Questions

What is the IUPAC name of N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile?
The IUPAC name of N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile (CID 162044881) is N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile.
What is the SMILES notation for N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile?
The canonical SMILES for N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile is CC1(C)c2cccc3ccc4cc(N(c5ccc(-c6ccccc6)cc5)c5ccc6c(c5)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5n6-c5ccccc5)cc1c4c23.CC1(C)c2cccc3ccc4cc(N(c5ccc(C#N)cc5)c5ccc6c(c5)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5n6-c5ccccc5)cc1c4c23.CC1(C)c2cccc3ccc4cc(N(c5ccc(F)cc5)c5ccc6c(c5)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5n6-c5ccccc5)cc1c4c23.CC1(C)c2cccc3ccc4cc(N(c5ccc6ccccc6c5)c5ccc6c(c5)c5cc([Si](c7ccccc7)(c7ccccc7)c7ccccc7)ccc5n6-c5ccccc5)cc1c4c23.
What is the InChIKey of N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile?
The InChIKey is YXTIQSKBXZHMLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H48N2Si.C63H46N2Si.C60H43N3Si.C59H43FN2Si/c1-65(2)59-30-18-21-47-31-32-48-41-52(43-60(65)64(48)63(47)59)66(50-35-33-46(34-36-50)45-19-8-3-9-20-45)51-37-39-61-57(42-51)58-44-56(38-40-62(58)67(61)49-22-10-4-11-23-49)68(53-24-12-5-13-25-53,54-26-14-6-15-27-54)55-28-16-7-17-29-55;1-63(2)57-29-17-20-44-30-31-46-39-50(41-58(63)62(46)61(44)57)64(48-33-32-43-18-15-16-19-45(43)38-48)49-34-36-59-55(40-49)56-42-54(35-37-60(56)65(59)47-21-7-3-8-22-47)66(51-23-9-4-10-24-51,52-25-11-5-12-26-52)53-27-13-6-14-28-53;1-60(2)54-25-15-16-42-28-29-43-36-47(38-55(60)59(43)58(42)54)62(45-30-26-41(40-61)27-31-45)46-32-34-56-52(37-46)53-39-51(33-35-57(53)63(56)44-17-7-3-8-18-44)64(48-19-9-4-10-20-48,49-21-11-5-12-22-49)50-23-13-6-14-24-50;1-59(2)53-25-15-16-40-26-27-41-36-46(38-54(59)58(41)57(40)53)61(44-30-28-42(60)29-31-44)45-32-34-55-51(37-45)52-39-50(33-35-56(52)62(55)43-17-7-3-8-18-43)63(47-19-9-4-10-20-47,48-21-11-5-12-22-48)49-23-13-6-14-24-49/h3-44H,1-2H3;3-42H,1-2H3;3-39H,1-2H3;3-39H,1-2H3.
What are the key properties of N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile?
N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile has a molecular weight of 3405.56 g/mol, XLogP of 53.14, 33 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-(4-fluorophenyl)-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-N-naphthalen-2-yl-9-phenyl-6-triphenylsilylcarbazol-3-amine;N-(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-9-phenyl-N-(4-phenylphenyl)-6-triphenylsilylcarbazol-3-amine;4-[(15,15-dimethyl-3-tetracyclo[10.2.1.05,14.08,13]pentadeca-1(14),2,4,6,8(13),9,11-heptaenyl)-(9-phenyl-6-triphenylsilylcarbazol-3-yl)amino]benzonitrile is sourced from PubChem (CID 162044881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).