3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene

C115H74N2O — CID 159917720

IUPAC3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6ccc7oc8ccccc8c7c6)c6ccccc56)ccc43)cc2)cc1.c1ccc(-c2cccc(C3c4ccccc4-c4cc(-c5ccc6c(c5)-c5ccccc5C6c5ccc(-c6ccc7c(c6)-c6ccccc6C7)cc5)ccc43)c2)cc1
InChIInChI=1S/C58H36N2O.C57H38/c1-2-12-37(13-3-1)38-22-27-42(28-23-38)59-52-19-9-6-16-46(52)49-34-39(24-30-55(49)59)40-25-31-56-50(35-40)47-17-7-10-20-53(47)60(56)54-32-29-43(44-14-4-5-15-45(44)54)41-26-33-58-51(36-41)48-18-8-11-21-57(48)61-58;1-2-11-36(12-3-1)39-14-10-15-45(31-39)57-50-20-9-7-18-48(50)55-35-42(28-30-52(55)57)41-27-29-51-54(34-41)47-17-6-8-19-49(47)56(51)38-23-21-37(22-24-38)40-25-26-44-32-43-13-4-5-16-46(43)53(44)33-40/h1-36H;1-31,33-35,56-57H,32H2
InChIKeyNXZQOGFKEVVHPR-UHFFFAOYSA-N
MW1499.87 g/mol
LogP30.51
Rot. Bonds10

About 3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene

3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene (PubChem CID 159917720) has the molecular formula C115H74N2O and a molecular weight of 1499.87 g/mol. Its IUPAC name is 3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene.

Molecular Properties

Compound Name3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene
PubChem CID159917720
Molecular FormulaC115H74N2O
Molecular Weight1499.87 g/mol
Exact Mass1498.58
IUPAC Name3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6ccc7oc8ccccc8c7c6)c6ccccc56)ccc43)cc2)cc1.c1ccc(-c2cccc(C3c4ccccc4-c4cc(-c5ccc6c(c5)-c5ccccc5C6c5ccc(-c6ccc7c(c6)-c6ccccc6C7)cc5)ccc43)c2)cc1
InChIInChI=1S/C58H36N2O.C57H38/c1-2-12-37(13-3-1)38-22-27-42(28-23-38)59-52-19-9-6-16-46(52)49-34-39(24-30-55(49)59)40-25-31-56-50(35-40)47-17-7-10-20-53(47)60(56)54-32-29-43(44-14-4-5-15-45(44)54)41-26-33-58-51(36-41)48-18-8-11-21-57(48)61-58;1-2-11-36(12-3-1)39-14-10-15-45(31-39)57-50-20-9-7-18-48(50)55-35-42(28-30-52(55)57)41-27-29-51-54(34-41)47-17-6-8-19-49(47)56(51)38-23-21-37(22-24-38)40-25-26-44-32-43-13-4-5-16-46(43)53(44)33-40/h1-36H;1-31,33-35,56-57H,32H2
InChIKeyNXZQOGFKEVVHPR-UHFFFAOYSA-N
XLogP30.51
TPSA23.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms118
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001499.87
LogP ≤ 530.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene?
The IUPAC name of 3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene (CID 159917720) is 3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene.
What is the SMILES notation for 3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene?
The canonical SMILES for 3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene is c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccc(-c6ccc7oc8ccccc8c7c6)c6ccccc56)ccc43)cc2)cc1.c1ccc(-c2cccc(C3c4ccccc4-c4cc(-c5ccc6c(c5)-c5ccccc5C6c5ccc(-c6ccc7c(c6)-c6ccccc6C7)cc5)ccc43)c2)cc1.
What is the InChIKey of 3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene?
The InChIKey is NXZQOGFKEVVHPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H36N2O.C57H38/c1-2-12-37(13-3-1)38-22-27-42(28-23-38)59-52-19-9-6-16-46(52)49-34-39(24-30-55(49)59)40-25-31-56-50(35-40)47-17-7-10-20-53(47)60(56)54-32-29-43(44-14-4-5-15-45(44)54)41-26-33-58-51(36-41)48-18-8-11-21-57(48)61-58;1-2-11-36(12-3-1)39-14-10-15-45(31-39)57-50-20-9-7-18-48(50)55-35-42(28-30-52(55)57)41-27-29-51-54(34-41)47-17-6-8-19-49(47)56(51)38-23-21-37(22-24-38)40-25-26-44-32-43-13-4-5-16-46(43)53(44)33-40/h1-36H;1-31,33-35,56-57H,32H2.
What are the key properties of 3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene?
3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene has a molecular weight of 1499.87 g/mol, XLogP of 30.51, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[9-(4-dibenzofuran-2-ylnaphthalen-1-yl)carbazol-3-yl]-9-(4-phenylphenyl)carbazole;3-[9-[4-(9H-fluoren-3-yl)phenyl]-9H-fluoren-3-yl]-9-(3-phenylphenyl)-9H-fluorene is sourced from PubChem (CID 159917720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).