9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole

C206H134N18 — CID 159200284

IUPAC9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c(-c5ccccc5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c(-c5ccccc5)cc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5ccccc5)c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccccc5)c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc43)n2)cc1
InChIInChI=1S/2C52H34N4.2C51H33N5/c1-5-17-35(18-6-1)40-30-32-49-51(50(40)38-29-31-48-43(33-38)41-25-13-15-27-46(41)55(48)39-23-11-4-12-24-39)42-26-14-16-28-47(42)56(49)52-53-44(36-19-7-2-8-20-36)34-45(54-52)37-21-9-3-10-22-37;1-5-17-35(18-6-1)43-33-51-45(32-42(43)38-29-30-50-44(31-38)40-25-13-15-27-48(40)55(50)39-23-11-4-12-24-39)41-26-14-16-28-49(41)56(51)52-53-46(36-19-7-2-8-20-36)34-47(54-52)37-21-9-3-10-22-37;1-5-17-34(18-6-1)47-39(37-29-31-45-42(33-37)40-25-13-15-27-43(40)55(45)38-23-11-4-12-24-38)30-32-46-48(47)41-26-14-16-28-44(41)56(46)51-53-49(35-19-7-2-8-20-35)52-50(54-51)36-21-9-3-10-22-36;1-5-17-34(18-6-1)41-32-44-40-26-14-16-28-46(40)56(51-53-49(35-19-7-2-8-20-35)52-50(54-51)36-21-9-3-10-22-36)48(44)33-42(41)37-29-30-47-43(31-37)39-25-13-15-27-45(39)55(47)38-23-11-4-12-24-38/h2*1-34H;2*1-33H
InChIKeyKPERQZPDXJTATL-UHFFFAOYSA-N
MW2861.46 g/mol
LogP52.15
Rot. Bonds24

About 9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole

9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole (PubChem CID 159200284) has the molecular formula C206H134N18 and a molecular weight of 2861.46 g/mol. Its IUPAC name is 9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole.

Molecular Properties

Compound Name9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
PubChem CID159200284
Molecular FormulaC206H134N18
Molecular Weight2861.46 g/mol
Exact Mass2859.10
IUPAC Name9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c(-c5ccccc5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c(-c5ccccc5)cc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5ccccc5)c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccccc5)c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc43)n2)cc1
InChIInChI=1S/2C52H34N4.2C51H33N5/c1-5-17-35(18-6-1)40-30-32-49-51(50(40)38-29-31-48-43(33-38)41-25-13-15-27-46(41)55(48)39-23-11-4-12-24-39)42-26-14-16-28-47(42)56(49)52-53-44(36-19-7-2-8-20-36)34-45(54-52)37-21-9-3-10-22-37;1-5-17-35(18-6-1)43-33-51-45(32-42(43)38-29-30-50-44(31-38)40-25-13-15-27-48(40)55(50)39-23-11-4-12-24-39)41-26-14-16-28-49(41)56(51)52-53-46(36-19-7-2-8-20-36)34-47(54-52)37-21-9-3-10-22-37;1-5-17-34(18-6-1)47-39(37-29-31-45-42(33-37)40-25-13-15-27-43(40)55(45)38-23-11-4-12-24-38)30-32-46-48(47)41-26-14-16-28-44(41)56(46)51-53-49(35-19-7-2-8-20-35)52-50(54-51)36-21-9-3-10-22-36;1-5-17-34(18-6-1)41-32-44-40-26-14-16-28-46(40)56(51-53-49(35-19-7-2-8-20-35)52-50(54-51)36-21-9-3-10-22-36)48(44)33-42(41)37-29-30-47-43(31-37)39-25-13-15-27-45(39)55(47)38-23-11-4-12-24-38/h2*1-34H;2*1-33H
InChIKeyKPERQZPDXJTATL-UHFFFAOYSA-N
XLogP52.15
TPSA168.34 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds24
Heavy Atoms224
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002861.46
LogP ≤ 552.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole with MolForge

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Related Compounds

4-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-2-yl]-3,9-diphenylcarbazole
CID 90321724
2-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-9-phenyl-3-(9-phenylcarbazol-3-yl)carbazole
CID 134598259
4-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole;3-[9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-4-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole;4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 157250623
3-(4,6-diphenylpyrimidin-2-yl)-9-phenyl-2-(9-phenylcarbazol-3-yl)carbazole
CID 90348761
9-(4,6-diphenylpyrimidin-2-yl)-2-(9-phenylcarbazol-3-yl)-6-[3-[4-phenyl-6-[2-(9-phenylcarbazol-3-yl)carbazol-9-yl]-1,3,5-triazin-2-yl]phenyl]carbazole
CID 138459281
9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]-9-phenylcarbazole;4-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-4-yl]-9-phenylcarbazole
CID 157253653
9-(4,6-diphenylpyrimidin-2-yl)-14-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-(4,6-diphenylpyrimidin-2-yl)-14-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-14-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-14-(4,6-diphenyl-1,3,5-triazin-2-yl)-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-14-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]-14-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 159568405
3-[9-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]carbazol-3-yl]-9-(4,6-diphenylpyrimidin-2-yl)carbazole;3-[9-[3-[4,6-bis(4-phenylphenyl)pyrimidin-2-yl]phenyl]carbazol-3-yl]-9-phenylcarbazole;3-[9-[4,6-bis(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazol-3-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 158018815
3-[2-[2,6-bis(2,6-diphenyl-4-pyridinyl)-4-pyridinyl]-5-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-9-phenylcarbazole
CID 139533350
3-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-4-yl]-9-phenylcarbazole
CID 118528300
3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-6-phenyl-1,3,5-triazin-2-yl]-9-phenylcarbazole
CID 146573165
4-(9-phenylcarbazol-3-yl)-9-[4-phenyl-6-[4-(9-phenylcarbazol-3-yl)carbazol-9-yl]-1,3,5-triazin-2-yl]carbazole
CID 137470533

Frequently Asked Questions

What is the IUPAC name of 9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole?
The IUPAC name of 9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole (CID 159200284) is 9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole.
What is the SMILES notation for 9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole?
The canonical SMILES for 9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole is c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c(-c5ccccc5)ccc43)n2)cc1.c1ccc(-c2cc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)c(-c5ccccc5)cc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5ccccc5)c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)ccc43)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccccc5)c(-c5ccc6c(c5)c5ccccc5n6-c5ccccc5)cc43)n2)cc1.
What is the InChIKey of 9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole?
The InChIKey is KPERQZPDXJTATL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C52H34N4.2C51H33N5/c1-5-17-35(18-6-1)40-30-32-49-51(50(40)38-29-31-48-43(33-38)41-25-13-15-27-46(41)55(48)39-23-11-4-12-24-39)42-26-14-16-28-47(42)56(49)52-53-44(36-19-7-2-8-20-36)34-45(54-52)37-21-9-3-10-22-37;1-5-17-35(18-6-1)43-33-51-45(32-42(43)38-29-30-50-44(31-38)40-25-13-15-27-48(40)55(50)39-23-11-4-12-24-39)41-26-14-16-28-49(41)56(51)52-53-46(36-19-7-2-8-20-36)34-47(54-52)37-21-9-3-10-22-37;1-5-17-34(18-6-1)47-39(37-29-31-45-42(33-37)40-25-13-15-27-43(40)55(45)38-23-11-4-12-24-38)30-32-46-48(47)41-26-14-16-28-44(41)56(46)51-53-49(35-19-7-2-8-20-35)52-50(54-51)36-21-9-3-10-22-36;1-5-17-34(18-6-1)41-32-44-40-26-14-16-28-46(40)56(51-53-49(35-19-7-2-8-20-35)52-50(54-51)36-21-9-3-10-22-36)48(44)33-42(41)37-29-30-47-43(31-37)39-25-13-15-27-45(39)55(47)38-23-11-4-12-24-38/h2*1-34H;2*1-33H.
What are the key properties of 9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole?
9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole has a molecular weight of 2861.46 g/mol, XLogP of 52.15, 24 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4,6-diphenylpyrimidin-2-yl)-2-phenyl-3-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenylpyrimidin-2-yl)-3-phenyl-4-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-2-(9-phenylcarbazol-3-yl)carbazole;9-(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenyl-3-(9-phenylcarbazol-3-yl)carbazole is sourced from PubChem (CID 159200284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).