9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole

C165H119N7 — CID 159871891

IUPAC9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole
SMILESCc1cc(C)cc(-c2cccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccccc4)n3)c2)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc(-c2cc(-c3ccc(-c4ccccc4)cc3)cc(-c3cccc(-n4c5ccc(C)cc5c5cc(C)ccc54)c3)n2)c1.c1ccc(-c2cc(-c3cccc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccccc6)ccc54)c3)nc(-c3cccc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccccc6)ccc54)c3)c2)cc1
InChIInChI=1S/C71H47N3.C57H43N3.C37H29N/c1-6-18-48(19-7-1)53-32-36-68-62(42-53)63-43-54(49-20-8-2-9-21-49)33-37-69(63)73(68)60-30-16-28-57(40-60)66-46-59(52-26-14-5-15-27-52)47-67(72-66)58-29-17-31-61(41-58)74-70-38-34-55(50-22-10-3-11-23-50)44-64(70)65-45-56(35-39-71(65)74)51-24-12-4-13-25-51;1-36-16-24-54-48(28-36)49-29-37(2)17-25-55(49)59(54)46-14-8-12-43(32-46)52-34-45(42-22-20-41(21-23-42)40-10-6-5-7-11-40)35-53(58-52)44-13-9-15-47(33-44)60-56-26-18-38(3)30-50(56)51-31-39(4)19-27-57(51)60;1-26-20-27(2)22-34(21-26)32-14-9-15-33(23-32)37-25-35(24-36(38-37)31-12-7-4-8-13-31)30-18-16-29(17-19-30)28-10-5-3-6-11-28/h1-47H;5-35H,1-4H3;3-25H,1-2H3
InChIKeyNSLMTNLSVHFMGK-UHFFFAOYSA-N
MW2199.82 g/mol
LogP44.16
Rot. Bonds20

About 9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole

9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole (PubChem CID 159871891) has the molecular formula C165H119N7 and a molecular weight of 2199.82 g/mol. Its IUPAC name is 9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole.

Molecular Properties

Compound Name9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole
PubChem CID159871891
Molecular FormulaC165H119N7
Molecular Weight2199.82 g/mol
Exact Mass2197.95
IUPAC Name9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole
SMILESCc1cc(C)cc(-c2cccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccccc4)n3)c2)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc(-c2cc(-c3ccc(-c4ccccc4)cc3)cc(-c3cccc(-n4c5ccc(C)cc5c5cc(C)ccc54)c3)n2)c1.c1ccc(-c2cc(-c3cccc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccccc6)ccc54)c3)nc(-c3cccc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccccc6)ccc54)c3)c2)cc1
InChIInChI=1S/C71H47N3.C57H43N3.C37H29N/c1-6-18-48(19-7-1)53-32-36-68-62(42-53)63-43-54(49-20-8-2-9-21-49)33-37-69(63)73(68)60-30-16-28-57(40-60)66-46-59(52-26-14-5-15-27-52)47-67(72-66)58-29-17-31-61(41-58)74-70-38-34-55(50-22-10-3-11-23-50)44-64(70)65-45-56(35-39-71(65)74)51-24-12-4-13-25-51;1-36-16-24-54-48(28-36)49-29-37(2)17-25-55(49)59(54)46-14-8-12-43(32-46)52-34-45(42-22-20-41(21-23-42)40-10-6-5-7-11-40)35-53(58-52)44-13-9-15-47(33-44)60-56-26-18-38(3)30-50(56)51-31-39(4)19-27-57(51)60;1-26-20-27(2)22-34(21-26)32-14-9-15-33(23-32)37-25-35(24-36(38-37)31-12-7-4-8-13-31)30-18-16-29(17-19-30)28-10-5-3-6-11-28/h1-47H;5-35H,1-4H3;3-25H,1-2H3
InChIKeyNSLMTNLSVHFMGK-UHFFFAOYSA-N
XLogP44.16
TPSA58.39 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds20
Heavy Atoms172
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002199.82
LogP ≤ 544.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole?
The IUPAC name of 9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole (CID 159871891) is 9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole.
What is the SMILES notation for 9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole?
The canonical SMILES for 9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole is Cc1cc(C)cc(-c2cccc(-c3cc(-c4ccc(-c5ccccc5)cc4)cc(-c4ccccc4)n3)c2)c1.Cc1ccc2c(c1)c1cc(C)ccc1n2-c1cccc(-c2cc(-c3ccc(-c4ccccc4)cc3)cc(-c3cccc(-n4c5ccc(C)cc5c5cc(C)ccc54)c3)n2)c1.c1ccc(-c2cc(-c3cccc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccccc6)ccc54)c3)nc(-c3cccc(-n4c5ccc(-c6ccccc6)cc5c5cc(-c6ccccc6)ccc54)c3)c2)cc1.
What is the InChIKey of 9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole?
The InChIKey is NSLMTNLSVHFMGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H47N3.C57H43N3.C37H29N/c1-6-18-48(19-7-1)53-32-36-68-62(42-53)63-43-54(49-20-8-2-9-21-49)33-37-69(63)73(68)60-30-16-28-57(40-60)66-46-59(52-26-14-5-15-27-52)47-67(72-66)58-29-17-31-61(41-58)74-70-38-34-55(50-22-10-3-11-23-50)44-64(70)65-45-56(35-39-71(65)74)51-24-12-4-13-25-51;1-36-16-24-54-48(28-36)49-29-37(2)17-25-55(49)59(54)46-14-8-12-43(32-46)52-34-45(42-22-20-41(21-23-42)40-10-6-5-7-11-40)35-53(58-52)44-13-9-15-47(33-44)60-56-26-18-38(3)30-50(56)51-31-39(4)19-27-57(51)60;1-26-20-27(2)22-34(21-26)32-14-9-15-33(23-32)37-25-35(24-36(38-37)31-12-7-4-8-13-31)30-18-16-29(17-19-30)28-10-5-3-6-11-28/h1-47H;5-35H,1-4H3;3-25H,1-2H3.
What are the key properties of 9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole?
9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole has a molecular weight of 2199.82 g/mol, XLogP of 44.16, 20 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-[6-[3-(3,6-dimethylcarbazol-9-yl)phenyl]-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-3,6-dimethylcarbazole;2-[3-(3,5-dimethylphenyl)phenyl]-6-phenyl-4-(4-phenylphenyl)pyridine;9-[3-[6-[3-(3,6-diphenylcarbazol-9-yl)phenyl]-4-phenyl-2-pyridinyl]phenyl]-3,6-diphenylcarbazole is sourced from PubChem (CID 159871891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).