4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine

C338H240N20 — CID 159649458

IUPAC4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine
SMILESCc1ccc(-c2cc3cc4c(cc(-c5ccc(C)cc5)n4-c4ccc(N(c5ccccc5)c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)cc3n2-c2ccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1.c1ccc(-c2cc3cc4c(cc(-c5ccccc5)n4-c4ccc(N(c5ccccc5)c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)cc3n2-c2ccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-n4c(-c5ccc6ccccc6c5)cc5cc6c(cc(-c7ccc8ccccc8c7)n6-c6ccc(N(c7ccc(-c8ccccc8)cc7)c7ccc8ccccc8c7)cc6)cc54)cc3)c3ccc4ccccc4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-n4c(-c5cccc6ccccc56)cc5cc6c(cc(-c7cccc8ccccc78)n6-c6ccc(N(c7ccc(-c8ccccc8)cc7)c7ccc8ccccc8c7)cc6)cc54)cc3)c3ccc4ccccc4c3)cc2)cc1
InChIInChI=1S/2C86H58N4.C84H64N6.C82H60N6/c1-3-15-59(16-4-1)65-31-37-75(38-32-65)87(81-41-35-63-21-9-13-25-69(63)53-81)77-43-47-79(48-44-77)89-83(71-29-27-61-19-7-11-23-67(61)51-71)55-73-58-86-74(57-85(73)89)56-84(72-30-28-62-20-8-12-24-68(62)52-72)90(86)80-49-45-78(46-50-80)88(82-42-36-64-22-10-14-26-70(64)54-82)76-39-33-66(34-40-76)60-17-5-2-6-18-60;1-3-17-59(18-4-1)63-33-39-71(40-34-63)87(77-43-37-61-21-7-9-25-67(61)53-77)73-45-49-75(50-46-73)89-83-55-70-58-86(82-32-16-28-66-24-12-14-30-80(66)82)90(84(70)56-69(83)57-85(89)81-31-15-27-65-23-11-13-29-79(65)81)76-51-47-74(48-52-76)88(78-44-38-62-22-8-10-26-68(62)54-78)72-41-35-64(36-42-72)60-19-5-2-6-20-60;1-61-33-37-63(38-34-61)81-57-65-59-84-66(60-83(65)89(81)79-53-49-77(50-54-79)87(71-29-17-7-18-30-71)75-45-41-73(42-46-75)85(67-21-9-3-10-22-67)68-23-11-4-12-24-68)58-82(64-39-35-62(2)36-40-64)90(84)80-55-51-78(52-56-80)88(72-31-19-8-20-32-72)76-47-43-74(44-48-76)86(69-25-13-5-14-26-69)70-27-15-6-16-28-70;1-9-25-61(26-10-1)79-57-63-59-82-64(60-81(63)87(79)77-53-49-75(50-54-77)85(69-37-21-7-22-38-69)73-45-41-71(42-46-73)83(65-29-13-3-14-30-65)66-31-15-4-16-32-66)58-80(62-27-11-2-12-28-62)88(82)78-55-51-76(52-56-78)86(70-39-23-8-24-40-70)74-47-43-72(44-48-74)84(67-33-17-5-18-34-67)68-35-19-6-20-36-68/h2*1-58H;3-60H,1-2H3;1-60H
InChIKeyMRJMYIMEYSUZQS-UHFFFAOYSA-N
MW4581.78 g/mol
LogP93.78
Rot. Bonds56

About 4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine

4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine (PubChem CID 159649458) has the molecular formula C338H240N20 and a molecular weight of 4581.78 g/mol. Its IUPAC name is 4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine.

Molecular Properties

Compound Name4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine
PubChem CID159649458
Molecular FormulaC338H240N20
Molecular Weight4581.78 g/mol
Exact Mass4577.94
IUPAC Name4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine
SMILESCc1ccc(-c2cc3cc4c(cc(-c5ccc(C)cc5)n4-c4ccc(N(c5ccccc5)c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)cc3n2-c2ccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1.c1ccc(-c2cc3cc4c(cc(-c5ccccc5)n4-c4ccc(N(c5ccccc5)c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)cc3n2-c2ccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-n4c(-c5ccc6ccccc6c5)cc5cc6c(cc(-c7ccc8ccccc8c7)n6-c6ccc(N(c7ccc(-c8ccccc8)cc7)c7ccc8ccccc8c7)cc6)cc54)cc3)c3ccc4ccccc4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-n4c(-c5cccc6ccccc56)cc5cc6c(cc(-c7cccc8ccccc78)n6-c6ccc(N(c7ccc(-c8ccccc8)cc7)c7ccc8ccccc8c7)cc6)cc54)cc3)c3ccc4ccccc4c3)cc2)cc1
InChIInChI=1S/2C86H58N4.C84H64N6.C82H60N6/c1-3-15-59(16-4-1)65-31-37-75(38-32-65)87(81-41-35-63-21-9-13-25-69(63)53-81)77-43-47-79(48-44-77)89-83(71-29-27-61-19-7-11-23-67(61)51-71)55-73-58-86-74(57-85(73)89)56-84(72-30-28-62-20-8-12-24-68(62)52-72)90(86)80-49-45-78(46-50-80)88(82-42-36-64-22-10-14-26-70(64)54-82)76-39-33-66(34-40-76)60-17-5-2-6-18-60;1-3-17-59(18-4-1)63-33-39-71(40-34-63)87(77-43-37-61-21-7-9-25-67(61)53-77)73-45-49-75(50-46-73)89-83-55-70-58-86(82-32-16-28-66-24-12-14-30-80(66)82)90(84(70)56-69(83)57-85(89)81-31-15-27-65-23-11-13-29-79(65)81)76-51-47-74(48-52-76)88(78-44-38-62-22-8-10-26-68(62)54-78)72-41-35-64(36-42-72)60-19-5-2-6-20-60;1-61-33-37-63(38-34-61)81-57-65-59-84-66(60-83(65)89(81)79-53-49-77(50-54-79)87(71-29-17-7-18-30-71)75-45-41-73(42-46-75)85(67-21-9-3-10-22-67)68-23-11-4-12-24-68)58-82(64-39-35-62(2)36-40-64)90(84)80-55-51-78(52-56-80)88(72-31-19-8-20-32-72)76-47-43-74(44-48-76)86(69-25-13-5-14-26-69)70-27-15-6-16-28-70;1-9-25-61(26-10-1)79-57-63-59-82-64(60-81(63)87(79)77-53-49-75(50-54-77)85(69-37-21-7-22-38-69)73-45-41-71(42-46-73)83(65-29-13-3-14-30-65)66-31-15-4-16-32-66)58-80(62-27-11-2-12-28-62)88(82)78-55-51-76(52-56-78)86(70-39-23-8-24-40-70)74-47-43-72(44-48-74)84(67-33-17-5-18-34-67)68-35-19-6-20-36-68/h2*1-58H;3-60H,1-2H3;1-60H
InChIKeyMRJMYIMEYSUZQS-UHFFFAOYSA-N
XLogP93.78
TPSA78.32 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds56
Heavy Atoms358
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004581.78
LogP ≤ 593.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine with MolForge

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Related Compounds

N-[4-[2,6-bis(3-fluorophenyl)-1-[4-(4-methyl-N-(9-phenylcarbazol-3-yl)anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-methylphenyl)-9-phenylcarbazol-3-amine;N-(4-methylphenyl)-N-[4-[1-[4-(4-methyl-N-(9-phenylcarbazol-3-yl)anilino)phenyl]-2,6-bis(3-phenylphenyl)pyrrolo[2,3-f]indol-5-yl]phenyl]-9-phenylcarbazol-3-amine;N-(4-methylphenyl)-N-[4-[1-[4-(4-methyl-N-(9-phenylcarbazol-3-yl)anilino)phenyl]-2,6-bis(4-phenylphenyl)pyrrolo[2,3-f]indol-5-yl]phenyl]-9-phenylcarbazol-3-amine;N-(4-methylphenyl)-N-[4-[1-[4-(4-methyl-N-(9-phenylcarbazol-3-yl)anilino)phenyl]-2,6-dinaphthalen-1-ylpyrrolo[2,3-f]indol-5-yl]phenyl]-9-phenylcarbazol-3-amine
CID 159730746
6-benzo[b]carbazol-5-yl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 167038052
N-[4-[2-(4-benzo[b]carbazol-5-ylphenyl)phenyl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 134380685
7-naphthalen-1-yl-N-(4-naphthalen-2-ylphenyl)-N,9-diphenylcarbazol-2-amine
CID 146573851
N-(4-carbazol-9-ylphenyl)-4-naphthalen-2-yl-N-(4-naphthalen-1-ylphenyl)aniline;N-(4-carbazol-9-ylphenyl)-4-(4-naphthalen-2-ylphenyl)-N-[4-(4-naphthalen-1-ylphenyl)phenyl]aniline;N-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-2-ylphenyl)-4-phenylaniline
CID 157492697
4-(4-carbazol-9-ylphenyl)-N,N-diphenylaniline;4-(4-carbazol-9-ylphenyl)-N-(4-naphthalen-1-ylphenyl)-N-phenylaniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N,4-diphenylaniline;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenylnaphthalen-1-amine;N-[4-(4-carbazol-9-ylphenyl)phenyl]-N-phenylnaphthalen-2-amine
CID 159528912
N-(4-naphthalen-1-ylphenyl)-5-phenyl-N-(4-phenylphenyl)benzo[b]carbazol-8-amine
CID 155034274
N-(4-carbazol-9-ylphenyl)-4-(4-naphthalen-1-ylphenyl)-N-[4-(6-phenylnaphthalen-2-yl)phenyl]aniline
CID 146580365
3-(4-benzo[b]carbazol-5-ylphenyl)-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]aniline
CID 138467813
N-(4-carbazol-9-ylphenyl)-4-[4-(4-methylphenyl)phenyl]-N-[4-(6-phenylnaphthalen-2-yl)phenyl]aniline
CID 153490348
N-[4-(4-carbazol-9-ylphenyl)phenyl]-6-(3-methylphenyl)-N-[4-(4-phenylphenyl)phenyl]naphthalen-2-amine
CID 170092188
N-(4-phenylphenyl)-N-[3-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]naphthalen-2-amine
CID 118505881

Frequently Asked Questions

What is the IUPAC name of 4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine?
The IUPAC name of 4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine (CID 159649458) is 4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine.
What is the SMILES notation for 4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine?
The canonical SMILES for 4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine is Cc1ccc(-c2cc3cc4c(cc(-c5ccc(C)cc5)n4-c4ccc(N(c5ccccc5)c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)cc3n2-c2ccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1.c1ccc(-c2cc3cc4c(cc(-c5ccccc5)n4-c4ccc(N(c5ccccc5)c5ccc(N(c6ccccc6)c6ccccc6)cc5)cc4)cc3n2-c2ccc(N(c3ccccc3)c3ccc(N(c4ccccc4)c4ccccc4)cc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-n4c(-c5ccc6ccccc6c5)cc5cc6c(cc(-c7ccc8ccccc8c7)n6-c6ccc(N(c7ccc(-c8ccccc8)cc7)c7ccc8ccccc8c7)cc6)cc54)cc3)c3ccc4ccccc4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-n4c(-c5cccc6ccccc56)cc5cc6c(cc(-c7cccc8ccccc78)n6-c6ccc(N(c7ccc(-c8ccccc8)cc7)c7ccc8ccccc8c7)cc6)cc54)cc3)c3ccc4ccccc4c3)cc2)cc1.
What is the InChIKey of 4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine?
The InChIKey is MRJMYIMEYSUZQS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C86H58N4.C84H64N6.C82H60N6/c1-3-15-59(16-4-1)65-31-37-75(38-32-65)87(81-41-35-63-21-9-13-25-69(63)53-81)77-43-47-79(48-44-77)89-83(71-29-27-61-19-7-11-23-67(61)51-71)55-73-58-86-74(57-85(73)89)56-84(72-30-28-62-20-8-12-24-68(62)52-72)90(86)80-49-45-78(46-50-80)88(82-42-36-64-22-10-14-26-70(64)54-82)76-39-33-66(34-40-76)60-17-5-2-6-18-60;1-3-17-59(18-4-1)63-33-39-71(40-34-63)87(77-43-37-61-21-7-9-25-67(61)53-77)73-45-49-75(50-46-73)89-83-55-70-58-86(82-32-16-28-66-24-12-14-30-80(66)82)90(84(70)56-69(83)57-85(89)81-31-15-27-65-23-11-13-29-79(65)81)76-51-47-74(48-52-76)88(78-44-38-62-22-8-10-26-68(62)54-78)72-41-35-64(36-42-72)60-19-5-2-6-20-60;1-61-33-37-63(38-34-61)81-57-65-59-84-66(60-83(65)89(81)79-53-49-77(50-54-79)87(71-29-17-7-18-30-71)75-45-41-73(42-46-75)85(67-21-9-3-10-22-67)68-23-11-4-12-24-68)58-82(64-39-35-62(2)36-40-64)90(84)80-55-51-78(52-56-80)88(72-31-19-8-20-32-72)76-47-43-74(44-48-76)86(69-25-13-5-14-26-69)70-27-15-6-16-28-70;1-9-25-61(26-10-1)79-57-63-59-82-64(60-81(63)87(79)77-53-49-75(50-54-77)85(69-37-21-7-22-38-69)73-45-41-71(42-46-73)83(65-29-13-3-14-30-65)66-31-15-4-16-32-66)58-80(62-27-11-2-12-28-62)88(82)78-55-51-76(52-56-78)86(70-39-23-8-24-40-70)74-47-43-72(44-48-74)84(67-33-17-5-18-34-67)68-35-19-6-20-36-68/h2*1-58H;3-60H,1-2H3;1-60H.
What are the key properties of 4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine?
4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine has a molecular weight of 4581.78 g/mol, XLogP of 93.78, 56 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[4-[2,6-bis(4-methylphenyl)-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine;N-[4-[2,6-dinaphthalen-1-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;N-[4-[2,6-dinaphthalen-2-yl-1-[4-(N-naphthalen-2-yl-4-phenylanilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine;4-N-[4-[2,6-diphenyl-1-[4-(N-[4-(N-phenylanilino)phenyl]anilino)phenyl]pyrrolo[2,3-f]indol-5-yl]phenyl]-1-N,1-N,4-N-triphenylbenzene-1,4-diamine is sourced from PubChem (CID 159649458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).