N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine

C174H133N5S — CID 162216523

IUPACN-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccc6c(c5)sc5ccccc56)cc4)c4cccc5c4-c4ccccc4C5(C)C)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c4cccc5c4-c4ccccc4C5(C)C)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4-c4cccc5c6ccccc6n(-c6ccccc6)c45)c4cccc5c4-c4ccccc4C5(C)C)cc3)cc21
InChIInChI=1S/2C60H46N2.C54H41NS/c1-59(2)51-27-13-9-23-49(51)57-52(59)28-17-31-56(57)61(42-35-32-39(33-36-42)40-34-37-44-43-20-8-12-26-50(43)60(3,4)53(44)38-40)54-29-14-10-21-45(54)47-24-16-25-48-46-22-11-15-30-55(46)62(58(47)48)41-18-6-5-7-19-41;1-59(2)51-24-13-9-22-48(51)58-52(59)25-16-28-57(58)62(43-33-29-39(30-34-43)40-31-35-46-45-20-8-12-23-50(45)60(3,4)53(46)38-40)54-26-14-10-19-44(54)41-32-36-56-49(37-41)47-21-11-15-27-55(47)61(56)42-17-6-5-7-18-42;1-53(2)46-16-9-6-14-44(46)52-47(53)17-11-18-49(52)55(39-28-22-35(23-29-39)37-25-31-43-42-13-7-10-19-50(42)56-51(43)33-37)38-26-20-34(21-27-38)36-24-30-41-40-12-5-8-15-45(40)54(3,4)48(41)32-36/h2*5-38H,1-4H3;5-33H,1-4H3
InChIKeyZTNRHPKPKHXFMT-UHFFFAOYSA-N
MW2326.08 g/mol
LogP47.87
Rot. Bonds17

About N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine

N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine (PubChem CID 162216523) has the molecular formula C174H133N5S and a molecular weight of 2326.08 g/mol. Its IUPAC name is N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine.

Molecular Properties

Compound NameN-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine
PubChem CID162216523
Molecular FormulaC174H133N5S
Molecular Weight2326.08 g/mol
Exact Mass2324.03
IUPAC NameN-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccc6c(c5)sc5ccccc56)cc4)c4cccc5c4-c4ccccc4C5(C)C)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c4cccc5c4-c4ccccc4C5(C)C)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4-c4cccc5c6ccccc6n(-c6ccccc6)c45)c4cccc5c4-c4ccccc4C5(C)C)cc3)cc21
InChIInChI=1S/2C60H46N2.C54H41NS/c1-59(2)51-27-13-9-23-49(51)57-52(59)28-17-31-56(57)61(42-35-32-39(33-36-42)40-34-37-44-43-20-8-12-26-50(43)60(3,4)53(44)38-40)54-29-14-10-21-45(54)47-24-16-25-48-46-22-11-15-30-55(46)62(58(47)48)41-18-6-5-7-19-41;1-59(2)51-24-13-9-22-48(51)58-52(59)25-16-28-57(58)62(43-33-29-39(30-34-43)40-31-35-46-45-20-8-12-23-50(45)60(3,4)53(46)38-40)54-26-14-10-19-44(54)41-32-36-56-49(37-41)47-21-11-15-27-55(47)61(56)42-17-6-5-7-18-42;1-53(2)46-16-9-6-14-44(46)52-47(53)17-11-18-49(52)55(39-28-22-35(23-29-39)37-25-31-43-42-13-7-10-19-50(42)56-51(43)33-37)38-26-20-34(21-27-38)36-24-30-41-40-12-5-8-15-45(40)54(3,4)48(41)32-36/h2*5-38H,1-4H3;5-33H,1-4H3
InChIKeyZTNRHPKPKHXFMT-UHFFFAOYSA-N
XLogP47.87
TPSA19.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds17
Heavy Atoms180
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002326.08
LogP ≤ 547.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine?
The IUPAC name of N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine (CID 162216523) is N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine.
What is the SMILES notation for N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine?
The canonical SMILES for N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine is CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccc6c(c5)sc5ccccc56)cc4)c4cccc5c4-c4ccccc4C5(C)C)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)c4cccc5c4-c4ccccc4C5(C)C)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4-c4cccc5c6ccccc6n(-c6ccccc6)c45)c4cccc5c4-c4ccccc4C5(C)C)cc3)cc21.
What is the InChIKey of N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine?
The InChIKey is ZTNRHPKPKHXFMT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C60H46N2.C54H41NS/c1-59(2)51-27-13-9-23-49(51)57-52(59)28-17-31-56(57)61(42-35-32-39(33-36-42)40-34-37-44-43-20-8-12-26-50(43)60(3,4)53(44)38-40)54-29-14-10-21-45(54)47-24-16-25-48-46-22-11-15-30-55(46)62(58(47)48)41-18-6-5-7-19-41;1-59(2)51-24-13-9-22-48(51)58-52(59)25-16-28-57(58)62(43-33-29-39(30-34-43)40-31-35-46-45-20-8-12-23-50(45)60(3,4)53(46)38-40)54-26-14-10-19-44(54)41-32-36-56-49(37-41)47-21-11-15-27-55(47)61(56)42-17-6-5-7-18-42;1-53(2)46-16-9-6-14-44(46)52-47(53)17-11-18-49(52)55(39-28-22-35(23-29-39)37-25-31-43-42-13-7-10-19-50(42)56-51(43)33-37)38-26-20-34(21-27-38)36-24-30-41-40-12-5-8-15-45(40)54(3,4)48(41)32-36/h2*5-38H,1-4H3;5-33H,1-4H3.
What are the key properties of N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine?
N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine has a molecular weight of 2326.08 g/mol, XLogP of 47.87, 17 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzothiophen-3-ylphenyl)-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethylfluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-1-yl)phenyl]fluoren-4-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-9,9-dimethyl-N-[2-(9-phenylcarbazol-3-yl)phenyl]fluoren-4-amine is sourced from PubChem (CID 162216523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).