bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine

C280H196N12 — CID 159121295

IUPACbis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc(-c6cc(N(c7ccccc7)c7ccccc7)cc(N(c7ccccc7)c7ccccc7)c6)cc5)ccc43)cc2)cc1.c1ccc(-c2ccc(N(c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccccc5)cc4)cc(N(c4ccc(-c5ccccc5)cc4)c4ccc5ccccc5c4)c3)c3ccc4ccccc4c3)cc2)cc1.c1ccc(-c2ccc(N(c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccccc5)cc4)cc(N(c4ccc(-c5ccccc5)cc4)c4ccc5ccccc5c4)c3)c3ccc4ccccc4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3cc(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6ccccc6)cc5)cc4)cc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)c3)cc2)cc1
InChIInChI=1S/2C74H51N3.C72H51N3.C60H43N3/c2*1-4-16-52(17-5-1)57-28-37-64(38-29-57)75(67-43-34-55-22-10-12-24-60(55)46-67)69-48-63(62-36-45-74-72(50-62)71-26-14-15-27-73(71)77(74)66-41-32-59(33-42-66)54-20-8-3-9-21-54)49-70(51-69)76(68-44-35-56-23-11-13-25-61(56)47-68)65-39-30-58(31-40-65)53-18-6-2-7-19-53;1-6-18-52(19-7-1)55-34-41-64(42-35-55)73(62-24-12-4-13-25-62)67-48-61(49-68(51-67)74(63-26-14-5-15-27-63)65-43-36-56(37-44-65)53-20-8-2-9-21-53)59-32-30-58(31-33-59)60-40-47-72-70(50-60)69-28-16-17-29-71(69)75(72)66-45-38-57(39-46-66)54-22-10-3-11-23-54;1-6-18-44(19-7-1)45-34-37-54(38-35-45)63-59-29-17-16-28-57(59)58-42-48(36-39-60(58)63)46-30-32-47(33-31-46)49-40-55(61(50-20-8-2-9-21-50)51-22-10-3-11-23-51)43-56(41-49)62(52-24-12-4-13-25-52)53-26-14-5-15-27-53/h2*1-51H;1-51H;1-43H
InChIKeyKFSLYCJFDAHMLE-UHFFFAOYSA-N
MW3728.73 g/mol
LogP78.18
Rot. Bonds44

About bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine

bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine (PubChem CID 159121295) has the molecular formula C280H196N12 and a molecular weight of 3728.73 g/mol. Its IUPAC name is bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine.

Molecular Properties

Compound Namebis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine
PubChem CID159121295
Molecular FormulaC280H196N12
Molecular Weight3728.73 g/mol
Exact Mass3725.57
IUPAC Namebis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc(-c6cc(N(c7ccccc7)c7ccccc7)cc(N(c7ccccc7)c7ccccc7)c6)cc5)ccc43)cc2)cc1.c1ccc(-c2ccc(N(c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccccc5)cc4)cc(N(c4ccc(-c5ccccc5)cc4)c4ccc5ccccc5c4)c3)c3ccc4ccccc4c3)cc2)cc1.c1ccc(-c2ccc(N(c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccccc5)cc4)cc(N(c4ccc(-c5ccccc5)cc4)c4ccc5ccccc5c4)c3)c3ccc4ccccc4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3cc(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6ccccc6)cc5)cc4)cc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)c3)cc2)cc1
InChIInChI=1S/2C74H51N3.C72H51N3.C60H43N3/c2*1-4-16-52(17-5-1)57-28-37-64(38-29-57)75(67-43-34-55-22-10-12-24-60(55)46-67)69-48-63(62-36-45-74-72(50-62)71-26-14-15-27-73(71)77(74)66-41-32-59(33-42-66)54-20-8-3-9-21-54)49-70(51-69)76(68-44-35-56-23-11-13-25-61(56)47-68)65-39-30-58(31-40-65)53-18-6-2-7-19-53;1-6-18-52(19-7-1)55-34-41-64(42-35-55)73(62-24-12-4-13-25-62)67-48-61(49-68(51-67)74(63-26-14-5-15-27-63)65-43-36-56(37-44-65)53-20-8-2-9-21-53)59-32-30-58(31-33-59)60-40-47-72-70(50-60)69-28-16-17-29-71(69)75(72)66-45-38-57(39-46-66)54-22-10-3-11-23-54;1-6-18-44(19-7-1)45-34-37-54(38-35-45)63-59-29-17-16-28-57(59)58-42-48(36-39-60(58)63)46-30-32-47(33-31-46)49-40-55(61(50-20-8-2-9-21-50)51-22-10-3-11-23-51)43-56(41-49)62(52-24-12-4-13-25-52)53-26-14-5-15-27-53/h2*1-51H;1-51H;1-43H
InChIKeyKFSLYCJFDAHMLE-UHFFFAOYSA-N
XLogP78.18
TPSA45.64 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds44
Heavy Atoms292
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003728.73
LogP ≤ 578.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-N,1-N,3-N,3-N-tetranaphthalen-2-yl-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine
CID 129175591
3-N-naphthalen-1-yl-1-N-naphthalen-2-yl-1-N,3-N-diphenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]benzene-1,3-diamine
CID 129256040
N-[3-[9-(3,5-diphenylphenyl)carbazol-3-yl]phenyl]-N-(4-phenylphenyl)naphthalen-2-amine
CID 118087581
3-N-naphthalen-1-yl-1-N-naphthalen-2-yl-1-N,3-N-diphenyl-5-[4-(9-phenylcarbazol-3-yl)phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[3-(9-phenylcarbazol-3-yl)phenyl]benzene-1,3-diamine
CID 162088224
N-(4-naphthalen-2-ylphenyl)-6-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)naphthalen-2-amine
CID 166956432
3,6-bis[4-(4-carbazol-9-ylphenyl)phenyl]-9-naphthalen-2-ylcarbazole;N,N-diphenyl-4-[4-[6-[4-[4-(N-phenylanilino)phenyl]phenyl]-9-(4-phenylphenyl)carbazol-3-yl]phenyl]aniline
CID 159344155
1-N,1-N,3-N,3-N-tetraphenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine
CID 70645467
N-(4-carbazol-9-ylphenyl)-4-[6-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-yl]-N-phenylaniline
CID 59501688
N-(4-phenylphenyl)-N-[3-[9-(4-phenylphenyl)carbazol-2-yl]phenyl]naphthalen-2-amine
CID 118505881
N-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]-9-phenyl-N-(4-phenylphenyl)carbazol-3-amine
CID 174258329
N-(4-naphthalen-2-ylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 166956515
N-(4-carbazol-9-ylphenyl)-3-naphthalen-2-yl-N-phenylaniline
CID 135164563

Frequently Asked Questions

What is the IUPAC name of bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine?
The IUPAC name of bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine (CID 159121295) is bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine.
What is the SMILES notation for bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine?
The canonical SMILES for bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine is c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc(-c6cc(N(c7ccccc7)c7ccccc7)cc(N(c7ccccc7)c7ccccc7)c6)cc5)ccc43)cc2)cc1.c1ccc(-c2ccc(N(c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccccc5)cc4)cc(N(c4ccc(-c5ccccc5)cc4)c4ccc5ccccc5c4)c3)c3ccc4ccccc4c3)cc2)cc1.c1ccc(-c2ccc(N(c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc(-c5ccccc5)cc4)cc(N(c4ccc(-c5ccccc5)cc4)c4ccc5ccccc5c4)c3)c3ccc4ccccc4c3)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3cc(-c4ccc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6ccccc6)cc5)cc4)cc(N(c4ccccc4)c4ccc(-c5ccccc5)cc4)c3)cc2)cc1.
What is the InChIKey of bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine?
The InChIKey is KFSLYCJFDAHMLE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C74H51N3.C72H51N3.C60H43N3/c2*1-4-16-52(17-5-1)57-28-37-64(38-29-57)75(67-43-34-55-22-10-12-24-60(55)46-67)69-48-63(62-36-45-74-72(50-62)71-26-14-15-27-73(71)77(74)66-41-32-59(33-42-66)54-20-8-3-9-21-54)49-70(51-69)76(68-44-35-56-23-11-13-25-61(56)47-68)65-39-30-58(31-40-65)53-18-6-2-7-19-53;1-6-18-52(19-7-1)55-34-41-64(42-35-55)73(62-24-12-4-13-25-62)67-48-61(49-68(51-67)74(63-26-14-5-15-27-63)65-43-36-56(37-44-65)53-20-8-2-9-21-53)59-32-30-58(31-33-59)60-40-47-72-70(50-60)69-28-16-17-29-71(69)75(72)66-45-38-57(39-46-66)54-22-10-3-11-23-54;1-6-18-44(19-7-1)45-34-37-54(38-35-45)63-59-29-17-16-28-57(59)58-42-48(36-39-60(58)63)46-30-32-47(33-31-46)49-40-55(61(50-20-8-2-9-21-50)51-22-10-3-11-23-51)43-56(41-49)62(52-24-12-4-13-25-52)53-26-14-5-15-27-53/h2*1-51H;1-51H;1-43H.
What are the key properties of bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine?
bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine has a molecular weight of 3728.73 g/mol, XLogP of 78.18, 44 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-N,3-N-dinaphthalen-2-yl-1-N,3-N-bis(4-phenylphenyl)-5-[9-(4-phenylphenyl)carbazol-3-yl]benzene-1,3-diamine);1-N,3-N-diphenyl-1-N,3-N-bis(4-phenylphenyl)-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine;1-N,1-N,3-N,3-N-tetraphenyl-5-[4-[9-(4-phenylphenyl)carbazol-3-yl]phenyl]benzene-1,3-diamine is sourced from PubChem (CID 159121295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).