N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine

C216H135N3O4S2 — CID 159393114

IUPACN-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)-c4cc6ccccc6cc4C54c5ccccc5Sc5ccccc54)c4cccc5c4-c4ccccc4C54c5ccccc5Oc5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)C4(c6ccccc6Sc6ccccc64)c4cc6ccccc6cc4-5)c4cccc5c4-c4ccccc4C54c5ccccc5Oc5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4cccc5c4-c4ccccc4C54c5ccccc5Oc5ccccc54)c4cccc5c4-c4cc6ccccc6cc4C54c5ccccc5Oc5ccccc54)cc3)cc2)cc1
InChIInChI=1S/C72H45NO2.2C72H45NOS/c1-2-18-46(19-3-1)47-36-38-48(39-37-47)49-40-42-52(43-41-49)73(63-30-16-28-60-69(63)53-22-6-7-23-55(53)71(60)56-24-8-12-32-65(56)74-66-33-13-9-25-57(66)71)64-31-17-29-61-70(64)54-44-50-20-4-5-21-51(50)45-62(54)72(61)58-26-10-14-34-67(58)75-68-35-15-11-27-59(68)72;1-2-17-46(18-3-1)47-33-35-48(36-34-47)49-37-39-52(40-38-49)73(65-28-16-27-62-70(65)55-21-6-7-22-57(55)71(62)58-23-8-12-29-66(58)74-67-30-13-9-24-59(67)71)53-41-42-54-56-43-50-19-4-5-20-51(50)44-63(56)72(64(54)45-53)60-25-10-14-31-68(60)75-69-32-15-11-26-61(69)72;1-2-17-46(18-3-1)47-33-35-48(36-34-47)49-37-39-52(40-38-49)73(65-28-16-27-63-70(65)54-21-6-7-22-57(54)71(63)59-23-8-12-29-66(59)74-67-30-13-9-24-60(67)71)53-41-42-58-56(45-53)55-43-50-19-4-5-20-51(50)44-64(55)72(58)61-25-10-14-31-68(61)75-69-32-15-11-26-62(69)72/h3*1-45H
InChIKeyLMJIPHGGXFYQQA-UHFFFAOYSA-N
MW2900.61 g/mol
LogP56.46
Rot. Bonds15

About N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine

N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine (PubChem CID 159393114) has the molecular formula C216H135N3O4S2 and a molecular weight of 2900.61 g/mol. Its IUPAC name is N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine.

Molecular Properties

Compound NameN-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine
PubChem CID159393114
Molecular FormulaC216H135N3O4S2
Molecular Weight2900.61 g/mol
Exact Mass2897.99
IUPAC NameN-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine
SMILESc1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)-c4cc6ccccc6cc4C54c5ccccc5Sc5ccccc54)c4cccc5c4-c4ccccc4C54c5ccccc5Oc5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)C4(c6ccccc6Sc6ccccc64)c4cc6ccccc6cc4-5)c4cccc5c4-c4ccccc4C54c5ccccc5Oc5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4cccc5c4-c4ccccc4C54c5ccccc5Oc5ccccc54)c4cccc5c4-c4cc6ccccc6cc4C54c5ccccc5Oc5ccccc54)cc3)cc2)cc1
InChIInChI=1S/C72H45NO2.2C72H45NOS/c1-2-18-46(19-3-1)47-36-38-48(39-37-47)49-40-42-52(43-41-49)73(63-30-16-28-60-69(63)53-22-6-7-23-55(53)71(60)56-24-8-12-32-65(56)74-66-33-13-9-25-57(66)71)64-31-17-29-61-70(64)54-44-50-20-4-5-21-51(50)45-62(54)72(61)58-26-10-14-34-67(58)75-68-35-15-11-27-59(68)72;1-2-17-46(18-3-1)47-33-35-48(36-34-47)49-37-39-52(40-38-49)73(65-28-16-27-62-70(65)55-21-6-7-22-57(55)71(62)58-23-8-12-29-66(58)74-67-30-13-9-24-59(67)71)53-41-42-54-56-43-50-19-4-5-20-51(50)44-63(56)72(64(54)45-53)60-25-10-14-31-68(60)75-69-32-15-11-26-61(69)72;1-2-17-46(18-3-1)47-33-35-48(36-34-47)49-37-39-52(40-38-49)73(65-28-16-27-63-70(65)54-21-6-7-22-57(54)71(63)59-23-8-12-29-66(59)74-67-30-13-9-24-60(67)71)53-41-42-58-56(45-53)55-43-50-19-4-5-20-51(50)44-64(55)72(58)61-25-10-14-31-68(61)75-69-32-15-11-26-62(69)72/h3*1-45H
InChIKeyLMJIPHGGXFYQQA-UHFFFAOYSA-N
XLogP56.46
TPSA46.64 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds15
Heavy Atoms225
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002900.61
LogP ≤ 556.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine with MolForge

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Related Compounds

N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]thioxanthene-12,9'-fluorene]-2'-ylspiro[fluorene-9,9'-xanthene]-4-amine
CID 138477662
N-(4-phenylphenyl)-N-spiro[fluorene-9,9'-thioxanthene]-4-ylspiro[fluorene-9,9'-xanthene]-3-amine
CID 138476201
N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-4-ylspiro[fluorene-9,9'-xanthene]-3-amine
CID 138476202
N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-2-amine
CID 138477727
N-[2-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]thioxanthene-12,9'-fluorene]-4'-ylspiro[fluorene-9,9'-xanthene]-2-amine
CID 138476524
N-[2-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]thioxanthene-12,9'-fluorene]-2'-ylspiro[fluorene-9,9'-xanthene]-4-amine
CID 138477675
N-(9,9'-spirobi[fluorene]-2-yl)-N-spiro[fluorene-9,9'-thioxanthene]-4-ylspiro[fluorene-9,9'-xanthene]-3-amine
CID 138477601
N-[2-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine
CID 138477453
N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-thioxanthene]-3'-ylspiro[fluorene-9,9'-xanthene]-4-amine
CID 138477854
N-spiro[fluorene-9,9'-thioxanthene]-3-yl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-2-amine;N-spiro[fluorene-9,9'-thioxanthene]-4-yl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-2-amine;N-spiro[fluorene-9,9'-xanthene]-2-yl-N-spiro[fluorene-9,9'-xanthene]-3-ylspiro[fluorene-9,9'-xanthene]-2-amine
CID 160801103
N-[2-(4-phenylphenyl)phenyl]-N-spiro[benzo[c]fluorene-7,9'-thioxanthene]-10-ylspiro[fluorene-9,9'-xanthene]-2-amine;N-[2-(4-phenylphenyl)phenyl]-N-spiro[benzo[c]fluorene-7,9'-thioxanthene]-11-ylspiro[fluorene-9,9'-xanthene]-2-amine;N-[2-(4-phenylphenyl)phenyl]-N-spiro[benzo[g]fluorene-7,9'-thioxanthene]-9-ylspiro[fluorene-9,9'-xanthene]-2-amine
CID 161030964
N-[2-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-2-ylspiro[benzo[b]fluorene-11,9'-xanthene]-3-amine;N-[2-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-2-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine;N-[2-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-2-ylspiro[benzo[g]fluorene-7,9'-xanthene]-9-amine
CID 159817922

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine?
The IUPAC name of N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine (CID 159393114) is N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine.
What is the SMILES notation for N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine?
The canonical SMILES for N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)-c4cc6ccccc6cc4C54c5ccccc5Sc5ccccc54)c4cccc5c4-c4ccccc4C54c5ccccc5Oc5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4ccc5c(c4)C4(c6ccccc6Sc6ccccc64)c4cc6ccccc6cc4-5)c4cccc5c4-c4ccccc4C54c5ccccc5Oc5ccccc54)cc3)cc2)cc1.c1ccc(-c2ccc(-c3ccc(N(c4cccc5c4-c4ccccc4C54c5ccccc5Oc5ccccc54)c4cccc5c4-c4cc6ccccc6cc4C54c5ccccc5Oc5ccccc54)cc3)cc2)cc1.
What is the InChIKey of N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine?
The InChIKey is LMJIPHGGXFYQQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H45NO2.2C72H45NOS/c1-2-18-46(19-3-1)47-36-38-48(39-37-47)49-40-42-52(43-41-49)73(63-30-16-28-60-69(63)53-22-6-7-23-55(53)71(60)56-24-8-12-32-65(56)74-66-33-13-9-25-57(66)71)64-31-17-29-61-70(64)54-44-50-20-4-5-21-51(50)45-62(54)72(61)58-26-10-14-34-67(58)75-68-35-15-11-27-59(68)72;1-2-17-46(18-3-1)47-33-35-48(36-34-47)49-37-39-52(40-38-49)73(65-28-16-27-62-70(65)55-21-6-7-22-57(55)71(62)58-23-8-12-29-66(58)74-67-30-13-9-24-59(67)71)53-41-42-54-56-43-50-19-4-5-20-51(50)44-63(56)72(64(54)45-53)60-25-10-14-31-68(60)75-69-32-15-11-26-61(69)72;1-2-17-46(18-3-1)47-33-35-48(36-34-47)49-37-39-52(40-38-49)73(65-28-16-27-63-70(65)54-21-6-7-22-57(54)71(63)59-23-8-12-29-66(59)74-67-30-13-9-24-60(67)71)53-41-42-58-56(45-53)55-43-50-19-4-5-20-51(50)44-64(55)72(58)61-25-10-14-31-68(61)75-69-32-15-11-26-62(69)72/h3*1-45H.
What are the key properties of N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine?
N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine has a molecular weight of 2900.61 g/mol, XLogP of 56.46, 15 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-2-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[benzo[b]fluorene-11,9'-thioxanthene]-3-ylspiro[fluorene-9,9'-xanthene]-4-amine;N-[4-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-4-ylspiro[benzo[b]fluorene-11,9'-xanthene]-4-amine is sourced from PubChem (CID 159393114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).