[3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone

C263H184N10O4 — CID 161253111

IUPAC[3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone
SMILESCc1ccccc1-c1cc(-c2cccc(C(=O)c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)cc(-c2cccc(-c3ccccc3)c2)c1-c1ccc(C(C)(C)C)cc1.O=C(c1cccc(-c2cccc(-c3c(-c4ccccc4)cc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)cc3-c3ccccc3)c2)c1)c1cc(-c2ccccc2)cc(-c2ccccc2)c1.O=C(c1cccc(-c2cccc(-c3c(-c4ccccc4)cc(-c4ccccc4)cc3-c3ccccc3)c2)c1)c1cc(-c2cccc(-c3ccccn3)c2)cc(-c2cccc(-c3ccccn3)c2)c1.O=C(c1cccc(-c2cccc(-c3c(-c4ccccc4)nc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)nc3-c3ccccc3)c2)c1)c1cc(-c2ccccc2)cc(-c2ccccc2)c1
InChIInChI=1S/C70H47N3O.C68H45N5O.C65H44N2O.C60H48O/c74-67(63-44-60(48-22-7-1-8-23-48)43-61(45-63)49-24-9-2-10-25-49)58-38-20-35-55(41-58)54-34-19-37-57(40-54)66-64(50-26-11-3-12-27-50)46-62(47-65(66)51-28-13-4-14-29-51)56-36-21-39-59(42-56)70-72-68(52-30-15-5-16-31-52)71-69(73-70)53-32-17-6-18-33-53;74-64(60-44-58(46-22-7-1-8-23-46)43-59(45-60)47-24-9-2-10-25-47)55-37-20-35-53(41-55)52-34-19-36-54(40-52)61-62(48-26-11-3-12-27-48)69-67(70-63(61)49-28-13-4-14-29-49)56-38-21-39-57(42-56)68-72-65(50-30-15-5-16-31-50)71-66(73-68)51-32-17-6-18-33-51;68-65(59-41-56(50-26-14-28-52(36-50)62-32-10-12-34-66-62)40-57(42-59)51-27-15-29-53(37-51)63-33-11-13-35-67-63)55-31-17-25-49(39-55)48-24-16-30-54(38-48)64-60(46-20-6-2-7-21-46)43-58(45-18-4-1-5-19-45)44-61(64)47-22-8-3-9-23-47;1-41-18-14-15-29-55(41)57-40-52(39-56(58(57)45-30-32-54(33-31-45)60(2,3)4)48-27-16-25-46(34-48)42-19-8-5-9-20-42)47-26-17-28-49(35-47)59(61)53-37-50(43-21-10-6-11-22-43)36-51(38-53)44-23-12-7-13-24-44/h1-47H;1-45H;1-44H;5-40H,1-4H3
InChIKeyVBNPKGBNYYOWPL-UHFFFAOYSA-N
MW3548.43 g/mol
LogP67.24
Rot. Bonds44

About [3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone

[3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone (PubChem CID 161253111) has the molecular formula C263H184N10O4 and a molecular weight of 3548.43 g/mol. Its IUPAC name is [3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone.

Molecular Properties

Compound Name[3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone
PubChem CID161253111
Molecular FormulaC263H184N10O4
Molecular Weight3548.43 g/mol
Exact Mass3545.45
IUPAC Name[3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone
SMILESCc1ccccc1-c1cc(-c2cccc(C(=O)c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)cc(-c2cccc(-c3ccccc3)c2)c1-c1ccc(C(C)(C)C)cc1.O=C(c1cccc(-c2cccc(-c3c(-c4ccccc4)cc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)cc3-c3ccccc3)c2)c1)c1cc(-c2ccccc2)cc(-c2ccccc2)c1.O=C(c1cccc(-c2cccc(-c3c(-c4ccccc4)cc(-c4ccccc4)cc3-c3ccccc3)c2)c1)c1cc(-c2cccc(-c3ccccn3)c2)cc(-c2cccc(-c3ccccn3)c2)c1.O=C(c1cccc(-c2cccc(-c3c(-c4ccccc4)nc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)nc3-c3ccccc3)c2)c1)c1cc(-c2ccccc2)cc(-c2ccccc2)c1
InChIInChI=1S/C70H47N3O.C68H45N5O.C65H44N2O.C60H48O/c74-67(63-44-60(48-22-7-1-8-23-48)43-61(45-63)49-24-9-2-10-25-49)58-38-20-35-55(41-58)54-34-19-37-57(40-54)66-64(50-26-11-3-12-27-50)46-62(47-65(66)51-28-13-4-14-29-51)56-36-21-39-59(42-56)70-72-68(52-30-15-5-16-31-52)71-69(73-70)53-32-17-6-18-33-53;74-64(60-44-58(46-22-7-1-8-23-46)43-59(45-60)47-24-9-2-10-25-47)55-37-20-35-53(41-55)52-34-19-36-54(40-52)61-62(48-26-11-3-12-27-48)69-67(70-63(61)49-28-13-4-14-29-49)56-38-21-39-57(42-56)68-72-65(50-30-15-5-16-31-50)71-66(73-68)51-32-17-6-18-33-51;68-65(59-41-56(50-26-14-28-52(36-50)62-32-10-12-34-66-62)40-57(42-59)51-27-15-29-53(37-51)63-33-11-13-35-67-63)55-31-17-25-49(39-55)48-24-16-30-54(38-48)64-60(46-20-6-2-7-21-46)43-58(45-18-4-1-5-19-45)44-61(64)47-22-8-3-9-23-47;1-41-18-14-15-29-55(41)57-40-52(39-56(58(57)45-30-32-54(33-31-45)60(2,3)4)48-27-16-25-46(34-48)42-19-8-5-9-20-42)47-26-17-28-49(35-47)59(61)53-37-50(43-21-10-6-11-22-43)36-51(38-53)44-23-12-7-13-24-44/h1-47H;1-45H;1-44H;5-40H,1-4H3
InChIKeyVBNPKGBNYYOWPL-UHFFFAOYSA-N
XLogP67.24
TPSA197.18 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds44
Heavy Atoms277
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003548.43
LogP ≤ 567.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze [3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone with MolForge

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Frequently Asked Questions

What is the IUPAC name of [3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone?
The IUPAC name of [3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone (CID 161253111) is [3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone.
What is the SMILES notation for [3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone?
The canonical SMILES for [3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone is Cc1ccccc1-c1cc(-c2cccc(C(=O)c3cc(-c4ccccc4)cc(-c4ccccc4)c3)c2)cc(-c2cccc(-c3ccccc3)c2)c1-c1ccc(C(C)(C)C)cc1.O=C(c1cccc(-c2cccc(-c3c(-c4ccccc4)cc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)cc3-c3ccccc3)c2)c1)c1cc(-c2ccccc2)cc(-c2ccccc2)c1.O=C(c1cccc(-c2cccc(-c3c(-c4ccccc4)cc(-c4ccccc4)cc3-c3ccccc3)c2)c1)c1cc(-c2cccc(-c3ccccn3)c2)cc(-c2cccc(-c3ccccn3)c2)c1.O=C(c1cccc(-c2cccc(-c3c(-c4ccccc4)nc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c4)nc3-c3ccccc3)c2)c1)c1cc(-c2ccccc2)cc(-c2ccccc2)c1.
What is the InChIKey of [3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone?
The InChIKey is VBNPKGBNYYOWPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C70H47N3O.C68H45N5O.C65H44N2O.C60H48O/c74-67(63-44-60(48-22-7-1-8-23-48)43-61(45-63)49-24-9-2-10-25-49)58-38-20-35-55(41-58)54-34-19-37-57(40-54)66-64(50-26-11-3-12-27-50)46-62(47-65(66)51-28-13-4-14-29-51)56-36-21-39-59(42-56)70-72-68(52-30-15-5-16-31-52)71-69(73-70)53-32-17-6-18-33-53;74-64(60-44-58(46-22-7-1-8-23-46)43-59(45-60)47-24-9-2-10-25-47)55-37-20-35-53(41-55)52-34-19-36-54(40-52)61-62(48-26-11-3-12-27-48)69-67(70-63(61)49-28-13-4-14-29-49)56-38-21-39-57(42-56)68-72-65(50-30-15-5-16-31-50)71-66(73-68)51-32-17-6-18-33-51;68-65(59-41-56(50-26-14-28-52(36-50)62-32-10-12-34-66-62)40-57(42-59)51-27-15-29-53(37-51)63-33-11-13-35-67-63)55-31-17-25-49(39-55)48-24-16-30-54(38-48)64-60(46-20-6-2-7-21-46)43-58(45-18-4-1-5-19-45)44-61(64)47-22-8-3-9-23-47;1-41-18-14-15-29-55(41)57-40-52(39-56(58(57)45-30-32-54(33-31-45)60(2,3)4)48-27-16-25-46(34-48)42-19-8-5-9-20-42)47-26-17-28-49(35-47)59(61)53-37-50(43-21-10-6-11-22-43)36-51(38-53)44-23-12-7-13-24-44/h1-47H;1-45H;1-44H;5-40H,1-4H3.
What are the key properties of [3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone?
[3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone has a molecular weight of 3548.43 g/mol, XLogP of 67.24, 44 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-bis(3-pyridin-2-ylphenyl)phenyl]-[3-[3-(2,4,6-triphenylphenyl)phenyl]phenyl]methanone;[3-[4-(4-tert-butylphenyl)-3-(2-methylphenyl)-5-(3-phenylphenyl)phenyl]phenyl]-(3,5-diphenylphenyl)methanone;(3,5-diphenylphenyl)-[3-[3-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2,6-diphenylphenyl]phenyl]phenyl]methanone;(3,5-diphenylphenyl)-[3-[3-[2-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-4,6-diphenylpyrimidin-5-yl]phenyl]phenyl]methanone is sourced from PubChem (CID 161253111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).