1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol

C236H166F2N16O4 — CID 157369314

IUPAC1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol
SMILESCOc1ccc(N(c2ccc(N(c3ccc(CO)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1.Fc1ccc(N(c2ccc(N(c3ccc(F)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1.c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1.c1ccc(Oc2ccc(N(c3ccc(N(c4ccc(Oc5ccccc5)cc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)cc1
InChIInChI=1S/C66H46N4O2.C60H42N4.C56H42N4O2.C54H36F2N4/c1-5-17-47(18-6-1)69-63-27-15-13-25-59(63)61-45-53(37-43-65(61)69)67(51-33-39-57(40-34-51)71-55-21-9-3-10-22-55)49-29-31-50(32-30-49)68(52-35-41-58(42-36-52)72-56-23-11-4-12-24-56)54-38-44-66-62(46-54)60-26-14-16-28-64(60)70(66)48-19-7-2-8-20-48;1-5-17-45(18-6-1)61(51-37-39-59-55(41-51)53-25-13-15-27-57(53)63(59)47-21-9-3-10-22-47)49-33-29-43(30-34-49)44-31-35-50(36-32-44)62(46-19-7-2-8-20-46)52-38-40-60-56(42-52)54-26-14-16-28-58(54)64(60)48-23-11-4-12-24-48;1-62-48-32-28-45(29-33-48)58(47-31-35-56-52(37-47)50-17-9-11-19-54(50)60(56)41-14-6-3-7-15-41)44-26-24-43(25-27-44)57(42-22-20-39(38-61)21-23-42)46-30-34-55-51(36-46)49-16-8-10-18-53(49)59(55)40-12-4-2-5-13-40;55-37-19-23-41(24-20-37)57(45-31-33-53-49(35-45)47-15-7-9-17-51(47)59(53)39-11-3-1-4-12-39)43-27-29-44(30-28-43)58(42-25-21-38(56)22-26-42)46-32-34-54-50(36-46)48-16-8-10-18-52(48)60(54)40-13-5-2-6-14-40/h1-46H;1-42H;2-37,61H,38H2,1H3;1-36H
InChIKeyBJOIDQGLMOKYEF-UHFFFAOYSA-N
MW3328.03 g/mol
LogP64.31
Rot. Bonds39

About 1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol

1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol (PubChem CID 157369314) has the molecular formula C236H166F2N16O4 and a molecular weight of 3328.03 g/mol. Its IUPAC name is 1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol.

Molecular Properties

Compound Name1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol
PubChem CID157369314
Molecular FormulaC236H166F2N16O4
Molecular Weight3328.03 g/mol
Exact Mass3325.32
IUPAC Name1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol
SMILESCOc1ccc(N(c2ccc(N(c3ccc(CO)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1.Fc1ccc(N(c2ccc(N(c3ccc(F)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1.c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1.c1ccc(Oc2ccc(N(c3ccc(N(c4ccc(Oc5ccccc5)cc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)cc1
InChIInChI=1S/C66H46N4O2.C60H42N4.C56H42N4O2.C54H36F2N4/c1-5-17-47(18-6-1)69-63-27-15-13-25-59(63)61-45-53(37-43-65(61)69)67(51-33-39-57(40-34-51)71-55-21-9-3-10-22-55)49-29-31-50(32-30-49)68(52-35-41-58(42-36-52)72-56-23-11-4-12-24-56)54-38-44-66-62(46-54)60-26-14-16-28-64(60)70(66)48-19-7-2-8-20-48;1-5-17-45(18-6-1)61(51-37-39-59-55(41-51)53-25-13-15-27-57(53)63(59)47-21-9-3-10-22-47)49-33-29-43(30-34-49)44-31-35-50(36-32-44)62(46-19-7-2-8-20-46)52-38-40-60-56(42-52)54-26-14-16-28-58(54)64(60)48-23-11-4-12-24-48;1-62-48-32-28-45(29-33-48)58(47-31-35-56-52(37-47)50-17-9-11-19-54(50)60(56)41-14-6-3-7-15-41)44-26-24-43(25-27-44)57(42-22-20-39(38-61)21-23-42)46-30-34-55-51(36-46)49-16-8-10-18-53(49)59(55)40-12-4-2-5-13-40;55-37-19-23-41(24-20-37)57(45-31-33-53-49(35-45)47-15-7-9-17-51(47)59(53)39-11-3-1-4-12-39)43-27-29-44(30-28-43)58(42-25-21-38(56)22-26-42)46-32-34-54-50(36-46)48-16-8-10-18-52(48)60(54)40-13-5-2-6-14-40/h1-46H;1-42H;2-37,61H,38H2,1H3;1-36H
InChIKeyBJOIDQGLMOKYEF-UHFFFAOYSA-N
XLogP64.31
TPSA113.28 Ų
H-Bond Donors1
H-Bond Acceptors20
Rotatable Bonds39
Heavy Atoms258
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003328.03
LogP ≤ 564.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1020

Analyze 1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol with MolForge

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Related Compounds

[4-[[6-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-9-phenylcarbazol-3-yl]-(9-phenylcarbazol-3-yl)amino]phenyl]methanol
CID 88866500
N-(4-methoxyphenyl)-N-[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]-9-phenylcarbazol-3-amine
CID 58651978
N-[4-(4-fluorophenyl)phenyl]-N-[4-[4-[4-(4-fluorophenyl)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]phenyl]-9-phenylcarbazol-3-amine;4-[4-[4-[4-[4-(4-isocyanophenyl)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]-N-(9-phenylcarbazol-3-yl)anilino]phenyl]benzonitrile;[4-[4-[4-[4-[4-(4-methoxyphenyl)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]-N-(9-phenylcarbazol-3-yl)anilino]phenyl]phenyl]methanol;N-[4-(4-methylphenyl)phenyl]-N-[4-[4-[4-(4-methylphenyl)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]phenyl]-9-phenylcarbazol-3-amine
CID 159969179
9-(4-fluorophenyl)-N-[4-[4-[4-(4-fluorophenyl)-N-[9-(4-fluorophenyl)carbazol-3-yl]anilino]phenyl]phenyl]-N-[4-(4-fluorophenyl)phenyl]carbazol-3-amine
CID 59844874
1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine
CID 58983384
6-fluoro-N,9-diphenyl-N-(9-phenylcarbazol-2-yl)carbazol-2-amine
CID 138549150
N-[9-[4-[4-(4-carbazol-9-ylphenyl)phenyl]phenyl]carbazol-3-yl]-N,9-diphenylcarbazol-3-amine
CID 172537557
N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;1-N,1-N,4-N-triphenyl-4-N-[4-(4-phenyl-N-[4-(N-phenylanilino)phenyl]anilino)phenyl]benzene-1,4-diamine
CID 159618005
N,9-diphenyl-N-[9-[4-[4-[4-[3-(N-(9-phenylcarbazol-3-yl)anilino)carbazol-9-yl]phenyl]phenyl]phenyl]carbazol-3-yl]carbazol-3-amine
CID 172537472
9-(4-fluorophenyl)-N-[9-(4-fluorophenyl)carbazol-3-yl]-N-(4-phenoxyphenyl)-6-triphenylsilylcarbazol-3-amine
CID 59720542
4-[3-(N-[9-(4-methoxyphenyl)carbazol-3-yl]-4-phenylanilino)carbazol-9-yl]benzaldehyde
CID 126585558
N-(4-fluorophenyl)-N-[4-[4-(N-naphthalen-2-yl-4-phenylanilino)naphthalen-1-yl]phenyl]-9-phenylcarbazol-3-amine
CID 59181411

Frequently Asked Questions

What is the IUPAC name of 1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol?
The IUPAC name of 1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol (CID 157369314) is 1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol.
What is the SMILES notation for 1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol?
The canonical SMILES for 1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol is COc1ccc(N(c2ccc(N(c3ccc(CO)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1.Fc1ccc(N(c2ccc(N(c3ccc(F)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1.c1ccc(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)cc2)c2ccc3c(c2)c2ccccc2n3-c2ccccc2)cc1.c1ccc(Oc2ccc(N(c3ccc(N(c4ccc(Oc5ccccc5)cc4)c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc4c(c3)c3ccccc3n4-c3ccccc3)cc2)cc1.
What is the InChIKey of 1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol?
The InChIKey is BJOIDQGLMOKYEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H46N4O2.C60H42N4.C56H42N4O2.C54H36F2N4/c1-5-17-47(18-6-1)69-63-27-15-13-25-59(63)61-45-53(37-43-65(61)69)67(51-33-39-57(40-34-51)71-55-21-9-3-10-22-55)49-29-31-50(32-30-49)68(52-35-41-58(42-36-52)72-56-23-11-4-12-24-56)54-38-44-66-62(46-54)60-26-14-16-28-64(60)70(66)48-19-7-2-8-20-48;1-5-17-45(18-6-1)61(51-37-39-59-55(41-51)53-25-13-15-27-57(53)63(59)47-21-9-3-10-22-47)49-33-29-43(30-34-49)44-31-35-50(36-32-44)62(46-19-7-2-8-20-46)52-38-40-60-56(42-52)54-26-14-16-28-58(54)64(60)48-23-11-4-12-24-48;1-62-48-32-28-45(29-33-48)58(47-31-35-56-52(37-47)50-17-9-11-19-54(50)60(56)41-14-6-3-7-15-41)44-26-24-43(25-27-44)57(42-22-20-39(38-61)21-23-42)46-30-34-55-51(36-46)49-16-8-10-18-53(49)59(55)40-12-4-2-5-13-40;55-37-19-23-41(24-20-37)57(45-31-33-53-49(35-45)47-15-7-9-17-51(47)59(53)39-11-3-1-4-12-39)43-27-29-44(30-28-43)58(42-25-21-38(56)22-26-42)46-32-34-54-50(36-46)48-16-8-10-18-52(48)60(54)40-13-5-2-6-14-40/h1-46H;1-42H;2-37,61H,38H2,1H3;1-36H.
What are the key properties of 1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol?
1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol has a molecular weight of 3328.03 g/mol, XLogP of 64.31, 39 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,4-N-bis(4-fluorophenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;1-N,4-N-bis(4-phenoxyphenyl)-1-N,4-N-bis(9-phenylcarbazol-3-yl)benzene-1,4-diamine;N,9-diphenyl-N-[4-[4-(N-(9-phenylcarbazol-3-yl)anilino)phenyl]phenyl]carbazol-3-amine;[4-[4-(4-methoxy-N-(9-phenylcarbazol-3-yl)anilino)-N-(9-phenylcarbazol-3-yl)anilino]phenyl]methanol is sourced from PubChem (CID 157369314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).