6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline

C301H200N22 — CID 159909070

IUPAC6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5c(-c6ccccc6)n6nc(-c7ccccc7)c(-c7ccccc7)c6c6ccccc56)cc4)cc3)n2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4ccc(-c5ccc(-c6c(-c7ccccc7)n7nc(-c8ccccc8)c(-c8ccccc8)c7c7ccccc67)cc5)cc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc(-c6c(-c7ccccc7)n7nc(-c8ccccc8)c(-c8ccccc8)c7c7ccccc67)cc5)c4)n3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccc(-c5ccc(-c6c(-c7ccccc7)n7nc(-c8ccccc8)c(-c8ccccc8)c7c7ccccc67)cc5)cc4)nc(-c4ccccc4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5c(-c6ccccc6)n6nc(-c7ccccc7)c(-c7ccccc7)c6c6ccccc56)cc4)c3)n2)cc1
InChIInChI=1S/2C63H42N4.C62H41N5.C57H38N4.C56H37N5/c1-6-19-43(20-7-1)52-29-18-30-53(41-52)57-42-56(64-63(65-57)51-27-14-5-15-28-51)46-37-33-44(34-38-46)45-35-39-48(40-36-45)58-54-31-16-17-32-55(54)62-59(47-21-8-2-9-22-47)60(49-23-10-3-11-24-49)66-67(62)61(58)50-25-12-4-13-26-50;1-6-18-43(19-7-1)44-30-36-48(37-31-44)57-42-56(47-20-8-2-9-21-47)64-63(65-57)53-40-34-46(35-41-53)45-32-38-50(39-33-45)58-54-28-16-17-29-55(54)62-59(49-22-10-3-11-23-49)60(51-24-12-4-13-25-51)66-67(62)61(58)52-26-14-5-15-27-52;1-6-19-42(20-7-1)43-35-39-50(40-36-43)61-63-60(49-27-14-5-15-28-49)64-62(65-61)52-30-18-29-51(41-52)44-33-37-46(38-34-44)55-53-31-16-17-32-54(53)59-56(45-21-8-2-9-22-45)57(47-23-10-3-11-24-47)66-67(59)58(55)48-25-12-4-13-26-48;1-6-18-41(19-7-1)50-38-51(42-20-8-2-9-21-42)59-57(58-50)47-36-32-40(33-37-47)39-30-34-44(35-31-39)52-48-28-16-17-29-49(48)56-53(43-22-10-3-11-23-43)54(45-24-12-4-13-25-45)60-61(56)55(52)46-26-14-5-15-27-46;1-6-19-39(20-7-1)50-51(41-21-8-2-9-22-41)60-61-52(42-23-10-3-11-24-42)49(47-31-16-17-32-48(47)53(50)61)40-35-33-38(34-36-40)45-29-18-30-46(37-45)56-58-54(43-25-12-4-13-26-43)57-55(59-56)44-27-14-5-15-28-44/h2*1-42H;1-41H;1-38H;1-37H
InChIKeyNWYHMNJSLAXDMJ-UHFFFAOYSA-N
MW4125.06 g/mol
LogP76.86
Rot. Bonds43

About 6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline

6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline (PubChem CID 159909070) has the molecular formula C301H200N22 and a molecular weight of 4125.06 g/mol. Its IUPAC name is 6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline.

Molecular Properties

Compound Name6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline
PubChem CID159909070
Molecular FormulaC301H200N22
Molecular Weight4125.06 g/mol
Exact Mass4121.63
IUPAC Name6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5c(-c6ccccc6)n6nc(-c7ccccc7)c(-c7ccccc7)c6c6ccccc56)cc4)cc3)n2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4ccc(-c5ccc(-c6c(-c7ccccc7)n7nc(-c8ccccc8)c(-c8ccccc8)c7c7ccccc67)cc5)cc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc(-c6c(-c7ccccc7)n7nc(-c8ccccc8)c(-c8ccccc8)c7c7ccccc67)cc5)c4)n3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccc(-c5ccc(-c6c(-c7ccccc7)n7nc(-c8ccccc8)c(-c8ccccc8)c7c7ccccc67)cc5)cc4)nc(-c4ccccc4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5c(-c6ccccc6)n6nc(-c7ccccc7)c(-c7ccccc7)c6c6ccccc56)cc4)c3)n2)cc1
InChIInChI=1S/2C63H42N4.C62H41N5.C57H38N4.C56H37N5/c1-6-19-43(20-7-1)52-29-18-30-53(41-52)57-42-56(64-63(65-57)51-27-14-5-15-28-51)46-37-33-44(34-38-46)45-35-39-48(40-36-45)58-54-31-16-17-32-55(54)62-59(47-21-8-2-9-22-47)60(49-23-10-3-11-24-49)66-67(62)61(58)50-25-12-4-13-26-50;1-6-18-43(19-7-1)44-30-36-48(37-31-44)57-42-56(47-20-8-2-9-21-47)64-63(65-57)53-40-34-46(35-41-53)45-32-38-50(39-33-45)58-54-28-16-17-29-55(54)62-59(49-22-10-3-11-23-49)60(51-24-12-4-13-25-51)66-67(62)61(58)52-26-14-5-15-27-52;1-6-19-42(20-7-1)43-35-39-50(40-36-43)61-63-60(49-27-14-5-15-28-49)64-62(65-61)52-30-18-29-51(41-52)44-33-37-46(38-34-44)55-53-31-16-17-32-54(53)59-56(45-21-8-2-9-22-45)57(47-23-10-3-11-24-47)66-67(59)58(55)48-25-12-4-13-26-48;1-6-18-41(19-7-1)50-38-51(42-20-8-2-9-21-42)59-57(58-50)47-36-32-40(33-37-47)39-30-34-44(35-31-39)52-48-28-16-17-29-49(48)56-53(43-22-10-3-11-23-43)54(45-24-12-4-13-25-45)60-61(56)55(52)46-26-14-5-15-27-46;1-6-19-39(20-7-1)50-51(41-21-8-2-9-22-41)60-61-52(42-23-10-3-11-24-42)49(47-31-16-17-32-48(47)53(50)61)40-35-33-38(34-36-40)45-29-18-30-46(37-45)56-58-54(43-25-12-4-13-26-43)57-55(59-56)44-27-14-5-15-28-44/h2*1-42H;1-41H;1-38H;1-37H
InChIKeyNWYHMNJSLAXDMJ-UHFFFAOYSA-N
XLogP76.86
TPSA241.18 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds43
Heavy Atoms323
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004125.06
LogP ≤ 576.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Analyze 6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline with MolForge

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Related Compounds

6-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-1,5-diphenyl-2-(4-phenylphenyl)pyrazolo[5,1-a]isoquinoline
CID 155159008
1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline
CID 155158485
6-[3-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline
CID 155158489
6-[3-[4-(3-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline
CID 155158480
1,2,5-triphenyl-6-[4-(10-phenylanthracen-9-yl)phenyl]pyrazolo[5,1-a]isoquinoline
CID 155159510
8-[4-[2,6-bis(3-phenylphenyl)pyrimidin-4-yl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline
CID 167328729
9-[4-[4,6-bis(3-phenylphenyl)pyrimidin-2-yl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline
CID 167328576
9-[3-[6-(3,5-diphenylphenyl)-2-phenylpyrimidin-4-yl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline
CID 167328744
6-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-phenanthren-9-yl-1,5-diphenylpyrazolo[5,1-a]isoquinoline
CID 155158471
8-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline
CID 167328851
1,5-diphenyl-6-[4-[4-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline
CID 155158969
1,2,5-triphenyl-9-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]pyrazolo[5,1-a]isoquinoline
CID 167328856

Frequently Asked Questions

What is the IUPAC name of 6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline?
The IUPAC name of 6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline (CID 159909070) is 6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline.
What is the SMILES notation for 6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline?
The canonical SMILES for 6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline is c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc(-c4ccc(-c5c(-c6ccccc6)n6nc(-c7ccccc7)c(-c7ccccc7)c6c6ccccc56)cc4)cc3)n2)cc1.c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4ccc(-c5ccc(-c6c(-c7ccccc7)n7nc(-c8ccccc8)c(-c8ccccc8)c7c7ccccc67)cc5)cc4)n3)cc2)cc1.c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5ccc(-c6c(-c7ccccc7)n7nc(-c8ccccc8)c(-c8ccccc8)c7c7ccccc67)cc5)c4)n3)cc2)cc1.c1ccc(-c2cccc(-c3cc(-c4ccc(-c5ccc(-c6c(-c7ccccc7)n7nc(-c8ccccc8)c(-c8ccccc8)c7c7ccccc67)cc5)cc4)nc(-c4ccccc4)n3)c2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc(-c4ccc(-c5c(-c6ccccc6)n6nc(-c7ccccc7)c(-c7ccccc7)c6c6ccccc56)cc4)c3)n2)cc1.
What is the InChIKey of 6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline?
The InChIKey is NWYHMNJSLAXDMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C63H42N4.C62H41N5.C57H38N4.C56H37N5/c1-6-19-43(20-7-1)52-29-18-30-53(41-52)57-42-56(64-63(65-57)51-27-14-5-15-28-51)46-37-33-44(34-38-46)45-35-39-48(40-36-45)58-54-31-16-17-32-55(54)62-59(47-21-8-2-9-22-47)60(49-23-10-3-11-24-49)66-67(62)61(58)50-25-12-4-13-26-50;1-6-18-43(19-7-1)44-30-36-48(37-31-44)57-42-56(47-20-8-2-9-21-47)64-63(65-57)53-40-34-46(35-41-53)45-32-38-50(39-33-45)58-54-28-16-17-29-55(54)62-59(49-22-10-3-11-23-49)60(51-24-12-4-13-25-51)66-67(62)61(58)52-26-14-5-15-27-52;1-6-19-42(20-7-1)43-35-39-50(40-36-43)61-63-60(49-27-14-5-15-28-49)64-62(65-61)52-30-18-29-51(41-52)44-33-37-46(38-34-44)55-53-31-16-17-32-54(53)59-56(45-21-8-2-9-22-45)57(47-23-10-3-11-24-47)66-67(59)58(55)48-25-12-4-13-26-48;1-6-18-41(19-7-1)50-38-51(42-20-8-2-9-21-42)59-57(58-50)47-36-32-40(33-37-47)39-30-34-44(35-31-39)52-48-28-16-17-29-49(48)56-53(43-22-10-3-11-23-43)54(45-24-12-4-13-25-45)60-61(56)55(52)46-26-14-5-15-27-46;1-6-19-39(20-7-1)50-51(41-21-8-2-9-22-41)60-61-52(42-23-10-3-11-24-42)49(47-31-16-17-32-48(47)53(50)61)40-35-33-38(34-36-40)45-29-18-30-46(37-45)56-58-54(43-25-12-4-13-26-43)57-55(59-56)44-27-14-5-15-28-44/h2*1-42H;1-41H;1-38H;1-37H.
What are the key properties of 6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline?
6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline has a molecular weight of 4125.06 g/mol, XLogP of 76.86, 43 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;6-[4-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenyl]-1,2,5-triphenylpyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[2-phenyl-6-(3-phenylphenyl)pyrimidin-4-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[4-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline;1,2,5-triphenyl-6-[4-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]phenyl]pyrazolo[5,1-a]isoquinoline is sourced from PubChem (CID 159909070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).