10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene]

C92H58N2 — CID 155332991

IUPAC10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene]
SMILESc1ccc(-c2cc(-c3c4cccc(-c5cccc6c5-c5ccccc5C65c6ccccc6N(c6ccccc6)c6ccccc65)c4cc4c(-c5cccc6c5-c5ccccc5C65c6ccccc6N(c6ccccc6)c6ccccc65)cccc34)c3ccccc3c2)cc1
InChIInChI=1S/C92H58N2/c1-4-28-59(29-5-1)61-56-60-30-10-11-35-64(60)75(57-61)88-69-40-24-38-65(67-42-26-50-82-89(67)71-36-12-14-44-76(71)91(82)78-46-16-20-52-84(78)93(62-31-6-2-7-32-62)85-53-21-17-47-79(85)91)73(69)58-74-66(39-25-41-70(74)88)68-43-27-51-83-90(68)72-37-13-15-45-77(72)92(83)80-48-18-22-54-86(80)94(63-33-8-3-9-34-63)87-55-23-19-49-81(87)92/h1-58H
InChIKeyDYEHPEXSZCBQAX-UHFFFAOYSA-N
MW1191.49 g/mol
LogP24.11
Rot. Bonds6

About 10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene]

10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene] (PubChem CID 155332991) has the molecular formula C92H58N2 and a molecular weight of 1191.49 g/mol. Its IUPAC name is 10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene].

Molecular Properties

Compound Name10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene]
PubChem CID155332991
Molecular FormulaC92H58N2
Molecular Weight1191.49 g/mol
Exact Mass1190.46
IUPAC Name10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene]
SMILESc1ccc(-c2cc(-c3c4cccc(-c5cccc6c5-c5ccccc5C65c6ccccc6N(c6ccccc6)c6ccccc65)c4cc4c(-c5cccc6c5-c5ccccc5C65c6ccccc6N(c6ccccc6)c6ccccc65)cccc34)c3ccccc3c2)cc1
InChIInChI=1S/C92H58N2/c1-4-28-59(29-5-1)61-56-60-30-10-11-35-64(60)75(57-61)88-69-40-24-38-65(67-42-26-50-82-89(67)71-36-12-14-44-76(71)91(82)78-46-16-20-52-84(78)93(62-31-6-2-7-32-62)85-53-21-17-47-79(85)91)73(69)58-74-66(39-25-41-70(74)88)68-43-27-51-83-90(68)72-37-13-15-45-77(72)92(83)80-48-18-22-54-86(80)94(63-33-8-3-9-34-63)87-55-23-19-49-81(87)92/h1-58H
InChIKeyDYEHPEXSZCBQAX-UHFFFAOYSA-N
XLogP24.11
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms94
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001191.49
LogP ≤ 524.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene] with MolForge

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Related Compounds

4'-[10-(4,5-diphenylanthracen-9-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]-10-phenylspiro[acridine-9,9'-fluorene]
CID 155333996
4'-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-10-phenylspiro[acridine-9,9'-fluorene]
CID 146495788
1-[10-phenanthren-9-yl-8-(9,9,10-triphenylacridin-1-yl)anthracen-1-yl]-9,9,10-triphenylacridine
CID 155334645
4-[10-(9,9-diphenylfluoren-4-yl)-8-(9,9,10-triphenylacridin-4-yl)anthracen-1-yl]-9,9,10-triphenylacridine
CID 155333482
10-phenyl-4'-[6-phenyl-4-(3-phenylphenyl)-2-pyridinyl]spiro[acridine-9,9'-fluorene]
CID 146663709
N-naphthalen-1-yl-N-[2-(2-naphthalen-1-ylphenyl)phenyl]-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 135166872
10-phenyl-4'-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]spiro[acridine-9,9'-fluorene]
CID 139521151
4'-[3-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-10-phenylspiro[acridine-9,9'-fluorene]
CID 139521327
1-[8-(9,9-dimethyl-10-phenylacridin-1-yl)-10-spiro[fluorene-9,21'-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene]-4-ylanthracen-1-yl]-9,9-dimethyl-10-phenylacridine
CID 155334451
4'-naphthalen-1-yl-10-phenyl-2'-(4-phenylphenyl)spiro[acridine-9,5'-indeno[1,2-d]pyrimidine]
CID 118372572
N-[2-(2-naphthalen-1-ylphenyl)phenyl]-N,10-diphenylspiro[acridine-9,9'-fluorene]-4'-amine
CID 135166874
9,9,10-triphenyl-4-[10-spiro[benzo[c]fluorene-7,9'-fluorene]-11-yl-8-(9,9,10-triphenylacridin-4-yl)anthracen-1-yl]acridine
CID 155334465

Frequently Asked Questions

What is the IUPAC name of 10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene]?
The IUPAC name of 10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene] (CID 155332991) is 10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene].
What is the SMILES notation for 10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene]?
The canonical SMILES for 10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene] is c1ccc(-c2cc(-c3c4cccc(-c5cccc6c5-c5ccccc5C65c6ccccc6N(c6ccccc6)c6ccccc65)c4cc4c(-c5cccc6c5-c5ccccc5C65c6ccccc6N(c6ccccc6)c6ccccc65)cccc34)c3ccccc3c2)cc1.
What is the InChIKey of 10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene]?
The InChIKey is DYEHPEXSZCBQAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C92H58N2/c1-4-28-59(29-5-1)61-56-60-30-10-11-35-64(60)75(57-61)88-69-40-24-38-65(67-42-26-50-82-89(67)71-36-12-14-44-76(71)91(82)78-46-16-20-52-84(78)93(62-31-6-2-7-32-62)85-53-21-17-47-79(85)91)73(69)58-74-66(39-25-41-70(74)88)68-43-27-51-83-90(68)72-37-13-15-45-77(72)92(83)80-48-18-22-54-86(80)94(63-33-8-3-9-34-63)87-55-23-19-49-81(87)92/h1-58H.
What are the key properties of 10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene]?
10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene] has a molecular weight of 1191.49 g/mol, XLogP of 24.11, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-phenyl-4'-[10-(3-phenylnaphthalen-1-yl)-8-(10-phenylspiro[acridine-9,9'-fluorene]-4'-yl)anthracen-1-yl]spiro[acridine-9,9'-fluorene] is sourced from PubChem (CID 155332991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).