9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline

C200H124N22 — CID 158208196

IUPAC9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline
SMILESc1ccc2cc(-c3nc(-c4ccc(-c5ccc(-c6cc(-c7cccc8cccnc78)nc(-c7ccc8ccccc8c7)n6)cc5)cc4)cc(-c4ccc(-c5cccc6cccnc56)cc4)n3)ccc2c1.c1ccc2ncc(-c3cc(-c4ccc(-c5ccc(-c6cc(-c7cnc8ccccc8c7)nc(-c7ccc(-n8c9ccccc9c9ccccc98)cc7)n6)cc5)cc4)nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)n3)cc2c1.c1cnc2c(-c3ccc(-c4cc(-c5ccc(-c6ccc(-c7cc(-c8cccc9cccnc89)nc(-c8cccc9cccnc89)n7)cc6)cc5)nc(-c5cccc6cccnc56)n4)cc3)cccc2c1
InChIInChI=1S/C74H46N8.C64H40N6.C62H38N8/c1-7-19-63-53(13-1)41-55(45-75-63)67-43-65(77-73(79-67)51-33-37-57(38-34-51)81-69-21-9-3-15-59(69)60-16-4-10-22-70(60)81)49-29-25-47(26-30-49)48-27-31-50(32-28-48)66-44-68(56-42-54-14-2-8-20-64(54)76-46-56)80-74(78-66)52-35-39-58(40-36-52)82-71-23-11-5-17-61(71)62-18-6-12-24-72(62)82;1-3-11-51-37-53(33-23-41(51)9-1)63-67-57(39-58(68-63)48-31-25-45(26-32-48)55-17-5-13-49-15-7-35-65-61(49)55)46-27-19-43(20-28-46)44-21-29-47(30-22-44)59-40-60(56-18-6-14-50-16-8-36-66-62(50)56)70-64(69-59)54-34-24-42-10-2-4-12-52(42)38-54;1-9-45-13-5-33-63-57(45)49(17-1)41-25-31-44(32-26-41)54-37-53(67-61(68-54)51-19-3-11-47-15-7-35-65-59(47)51)42-27-21-39(22-28-42)40-23-29-43(30-24-40)55-38-56(50-18-2-10-46-14-6-34-64-58(46)50)70-62(69-55)52-20-4-12-48-16-8-36-66-60(48)52/h1-46H;1-40H;1-38H
InChIKeyGBTDPXXCEYNCCR-UHFFFAOYSA-N
MW2835.35 g/mol
LogP49.03
Rot. Bonds25

About 9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline

9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline (PubChem CID 158208196) has the molecular formula C200H124N22 and a molecular weight of 2835.35 g/mol. Its IUPAC name is 9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline.

Molecular Properties

Compound Name9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline
PubChem CID158208196
Molecular FormulaC200H124N22
Molecular Weight2835.35 g/mol
Exact Mass2833.04
IUPAC Name9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline
SMILESc1ccc2cc(-c3nc(-c4ccc(-c5ccc(-c6cc(-c7cccc8cccnc78)nc(-c7ccc8ccccc8c7)n6)cc5)cc4)cc(-c4ccc(-c5cccc6cccnc56)cc4)n3)ccc2c1.c1ccc2ncc(-c3cc(-c4ccc(-c5ccc(-c6cc(-c7cnc8ccccc8c7)nc(-c7ccc(-n8c9ccccc9c9ccccc98)cc7)n6)cc5)cc4)nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)n3)cc2c1.c1cnc2c(-c3ccc(-c4cc(-c5ccc(-c6ccc(-c7cc(-c8cccc9cccnc89)nc(-c8cccc9cccnc89)n7)cc6)cc5)nc(-c5cccc6cccnc56)n4)cc3)cccc2c1
InChIInChI=1S/C74H46N8.C64H40N6.C62H38N8/c1-7-19-63-53(13-1)41-55(45-75-63)67-43-65(77-73(79-67)51-33-37-57(38-34-51)81-69-21-9-3-15-59(69)60-16-4-10-22-70(60)81)49-29-25-47(26-30-49)48-27-31-50(32-28-48)66-44-68(56-42-54-14-2-8-20-64(54)76-46-56)80-74(78-66)52-35-39-58(40-36-52)82-71-23-11-5-17-61(71)62-18-6-12-24-72(62)82;1-3-11-51-37-53(33-23-41(51)9-1)63-67-57(39-58(68-63)48-31-25-45(26-32-48)55-17-5-13-49-15-7-35-65-61(49)55)46-27-19-43(20-28-46)44-21-29-47(30-22-44)59-40-60(56-18-6-14-50-16-8-36-66-62(50)56)70-64(69-59)54-34-24-42-10-2-4-12-52(42)38-54;1-9-45-13-5-33-63-57(45)49(17-1)41-25-31-44(32-26-41)54-37-53(67-61(68-54)51-19-3-11-47-15-7-35-65-59(47)51)42-27-21-39(22-28-42)40-23-29-43(30-24-40)55-38-56(50-18-2-10-46-14-6-34-64-58(46)50)70-62(69-55)52-20-4-12-48-16-8-36-66-60(48)52/h1-46H;1-40H;1-38H
InChIKeyGBTDPXXCEYNCCR-UHFFFAOYSA-N
XLogP49.03
TPSA267.66 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds25
Heavy Atoms222
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002835.35
LogP ≤ 549.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze 9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline?
The IUPAC name of 9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline (CID 158208196) is 9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline.
What is the SMILES notation for 9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline?
The canonical SMILES for 9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline is c1ccc2cc(-c3nc(-c4ccc(-c5ccc(-c6cc(-c7cccc8cccnc78)nc(-c7ccc8ccccc8c7)n6)cc5)cc4)cc(-c4ccc(-c5cccc6cccnc56)cc4)n3)ccc2c1.c1ccc2ncc(-c3cc(-c4ccc(-c5ccc(-c6cc(-c7cnc8ccccc8c7)nc(-c7ccc(-n8c9ccccc9c9ccccc98)cc7)n6)cc5)cc4)nc(-c4ccc(-n5c6ccccc6c6ccccc65)cc4)n3)cc2c1.c1cnc2c(-c3ccc(-c4cc(-c5ccc(-c6ccc(-c7cc(-c8cccc9cccnc89)nc(-c8cccc9cccnc89)n7)cc6)cc5)nc(-c5cccc6cccnc56)n4)cc3)cccc2c1.
What is the InChIKey of 9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline?
The InChIKey is GBTDPXXCEYNCCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H46N8.C64H40N6.C62H38N8/c1-7-19-63-53(13-1)41-55(45-75-63)67-43-65(77-73(79-67)51-33-37-57(38-34-51)81-69-21-9-3-15-59(69)60-16-4-10-22-70(60)81)49-29-25-47(26-30-49)48-27-31-50(32-28-48)66-44-68(56-42-54-14-2-8-20-64(54)76-46-56)80-74(78-66)52-35-39-58(40-36-52)82-71-23-11-5-17-61(71)62-18-6-12-24-72(62)82;1-3-11-51-37-53(33-23-41(51)9-1)63-67-57(39-58(68-63)48-31-25-45(26-32-48)55-17-5-13-49-15-7-35-65-61(49)55)46-27-19-43(20-28-46)44-21-29-47(30-22-44)59-40-60(56-18-6-14-50-16-8-36-66-62(50)56)70-64(69-59)54-34-24-42-10-2-4-12-52(42)38-54;1-9-45-13-5-33-63-57(45)49(17-1)41-25-31-44(32-26-41)54-37-53(67-61(68-54)51-19-3-11-47-15-7-35-65-59(47)51)42-27-21-39(22-28-42)40-23-29-43(30-24-40)55-38-56(50-18-2-10-46-14-6-34-64-58(46)50)70-62(69-55)52-20-4-12-48-16-8-36-66-60(48)52/h1-46H;1-40H;1-38H.
What are the key properties of 9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline?
9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline has a molecular weight of 2835.35 g/mol, XLogP of 49.03, 25 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[4-[4-[4-[2-(4-carbazol-9-ylphenyl)-6-quinolin-3-ylpyrimidin-4-yl]phenyl]phenyl]-6-quinolin-3-ylpyrimidin-2-yl]phenyl]carbazole;8-[4-[4-[4-[2,6-di(quinolin-8-yl)pyrimidin-4-yl]phenyl]phenyl]-6-(4-quinolin-8-ylphenyl)pyrimidin-2-yl]quinoline;8-[2-naphthalen-2-yl-6-[4-[4-[2-naphthalen-2-yl-6-(4-quinolin-8-ylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrimidin-4-yl]quinoline is sourced from PubChem (CID 158208196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).