9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole

C156H112N4 — CID 158925284

IUPAC9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole
SMILESCCn1c2ccc(-c3ccccc3)cc2c2cc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6ccc7c(c6)c6cc(-c8ccc(-c9ccccc9)cc8)ccc6n7CC)cc5)c5ccccc45)cc3)ccc21.CCn1c2ccc(-c3ccccc3)cc2c2cc(-c3ccc(-c4ccc(-c5c6ccccc6c(-c6ccc(-c7ccc(-c8ccc9c(c8)c8cc(-c%10ccc(-c%11ccccc%11)cc%10)ccc8n9CC)cc7)cc6)c6ccccc56)cc4)cc3)ccc21
InChIInChI=1S/C84H60N2.C72H52N2/c1-3-85-79-47-43-67(56-17-9-6-10-18-56)51-75(79)76-52-69(45-48-80(76)85)63-31-25-58(26-32-63)60-35-39-65(40-36-60)83-71-19-11-13-21-73(71)84(74-22-14-12-20-72(74)83)66-41-37-61(38-42-66)59-27-33-64(34-28-59)70-46-50-82-78(54-70)77-53-68(44-49-81(77)86(82)4-2)62-29-23-57(24-30-62)55-15-7-5-8-16-55;1-3-73-67-39-35-55(48-17-9-6-10-18-48)43-63(67)64-45-57(37-41-68(64)73)51-27-31-53(32-28-51)71-59-19-11-13-21-61(59)72(62-22-14-12-20-60(62)71)54-33-29-52(30-34-54)58-38-42-70-66(46-58)65-44-56(36-40-69(65)74(70)4-2)50-25-23-49(24-26-50)47-15-7-5-8-16-47/h5-54H,3-4H2,1-2H3;5-46H,3-4H2,1-2H3
InChIKeyJIJBTOMXZKGZDT-UHFFFAOYSA-N
MW2042.64 g/mol
LogP43.17
Rot. Bonds20

About 9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole

9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole (PubChem CID 158925284) has the molecular formula C156H112N4 and a molecular weight of 2042.64 g/mol. Its IUPAC name is 9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole.

Molecular Properties

Compound Name9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole
PubChem CID158925284
Molecular FormulaC156H112N4
Molecular Weight2042.64 g/mol
Exact Mass2040.89
IUPAC Name9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole
SMILESCCn1c2ccc(-c3ccccc3)cc2c2cc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6ccc7c(c6)c6cc(-c8ccc(-c9ccccc9)cc8)ccc6n7CC)cc5)c5ccccc45)cc3)ccc21.CCn1c2ccc(-c3ccccc3)cc2c2cc(-c3ccc(-c4ccc(-c5c6ccccc6c(-c6ccc(-c7ccc(-c8ccc9c(c8)c8cc(-c%10ccc(-c%11ccccc%11)cc%10)ccc8n9CC)cc7)cc6)c6ccccc56)cc4)cc3)ccc21
InChIInChI=1S/C84H60N2.C72H52N2/c1-3-85-79-47-43-67(56-17-9-6-10-18-56)51-75(79)76-52-69(45-48-80(76)85)63-31-25-58(26-32-63)60-35-39-65(40-36-60)83-71-19-11-13-21-73(71)84(74-22-14-12-20-72(74)83)66-41-37-61(38-42-66)59-27-33-64(34-28-59)70-46-50-82-78(54-70)77-53-68(44-49-81(77)86(82)4-2)62-29-23-57(24-30-62)55-15-7-5-8-16-55;1-3-73-67-39-35-55(48-17-9-6-10-18-48)43-63(67)64-45-57(37-41-68(64)73)51-27-31-53(32-28-51)71-59-19-11-13-21-61(59)72(62-22-14-12-20-60(62)71)54-33-29-52(30-34-54)58-38-42-70-66(46-58)65-44-56(36-40-69(65)74(70)4-2)50-25-23-49(24-26-50)47-15-7-5-8-16-47/h5-54H,3-4H2,1-2H3;5-46H,3-4H2,1-2H3
InChIKeyJIJBTOMXZKGZDT-UHFFFAOYSA-N
XLogP43.17
TPSA19.72 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds20
Heavy Atoms160
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002042.64
LogP ≤ 543.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole?
The IUPAC name of 9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole (CID 158925284) is 9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole.
What is the SMILES notation for 9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole?
The canonical SMILES for 9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole is CCn1c2ccc(-c3ccccc3)cc2c2cc(-c3ccc(-c4c5ccccc5c(-c5ccc(-c6ccc7c(c6)c6cc(-c8ccc(-c9ccccc9)cc8)ccc6n7CC)cc5)c5ccccc45)cc3)ccc21.CCn1c2ccc(-c3ccccc3)cc2c2cc(-c3ccc(-c4ccc(-c5c6ccccc6c(-c6ccc(-c7ccc(-c8ccc9c(c8)c8cc(-c%10ccc(-c%11ccccc%11)cc%10)ccc8n9CC)cc7)cc6)c6ccccc56)cc4)cc3)ccc21.
What is the InChIKey of 9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole?
The InChIKey is JIJBTOMXZKGZDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H60N2.C72H52N2/c1-3-85-79-47-43-67(56-17-9-6-10-18-56)51-75(79)76-52-69(45-48-80(76)85)63-31-25-58(26-32-63)60-35-39-65(40-36-60)83-71-19-11-13-21-73(71)84(74-22-14-12-20-72(74)83)66-41-37-61(38-42-66)59-27-33-64(34-28-59)70-46-50-82-78(54-70)77-53-68(44-49-81(77)86(82)4-2)62-29-23-57(24-30-62)55-15-7-5-8-16-55;1-3-73-67-39-35-55(48-17-9-6-10-18-48)43-63(67)64-45-57(37-41-68(64)73)51-27-31-53(32-28-51)71-59-19-11-13-21-61(59)72(62-22-14-12-20-60(62)71)54-33-29-52(30-34-54)58-38-42-70-66(46-58)65-44-56(36-40-69(65)74(70)4-2)50-25-23-49(24-26-50)47-15-7-5-8-16-47/h5-54H,3-4H2,1-2H3;5-46H,3-4H2,1-2H3.
What are the key properties of 9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole?
9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole has a molecular weight of 2042.64 g/mol, XLogP of 43.17, 20 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-3-[4-[10-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]anthracen-9-yl]phenyl]-6-(4-phenylphenyl)carbazole;9-ethyl-3-[4-[4-[10-[4-[4-(9-ethyl-6-phenylcarbazol-3-yl)phenyl]phenyl]anthracen-9-yl]phenyl]phenyl]-6-(4-phenylphenyl)carbazole is sourced from PubChem (CID 158925284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).