6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole

C137H86N16O3 — CID 162158013

IUPAC6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole
SMILESc1ccc(-c2oc3c(ccc4c3c3ccccc3n4-c3cccc(-c4cc(-c5ccncc5)nc(-c5ccncc5)n4)c3)c2-c2ccccc2)cc1.c1ccc(-c2oc3c(ccc4c3c3ccccc3n4-c3cccc(-c4nc(-c5ccncc5)cc(-c5ccncc5)n4)c3)c2-c2ccccc2)cc1.c1ccc(-c2oc3c(ccc4c3c3ccccc3n4-c3cccc(-c4nc(-c5ccncc5)nc(-c5ccncc5)n4)c3)c2-c2ccccc2)cc1
InChIInChI=1S/2C46H29N5O.C45H28N6O/c1-3-10-32(11-4-1)42-37-18-19-41-43(45(37)52-44(42)33-12-5-2-6-13-33)36-16-7-8-17-40(36)51(41)35-15-9-14-34(28-35)46-49-38(30-20-24-47-25-21-30)29-39(50-46)31-22-26-48-27-23-31;1-3-10-31(11-4-1)42-37-18-19-41-43(45(37)52-44(42)32-12-5-2-6-13-32)36-16-7-8-17-40(36)51(41)35-15-9-14-34(28-35)39-29-38(30-20-24-47-25-21-30)49-46(50-39)33-22-26-48-27-23-33;1-3-10-29(11-4-1)39-36-18-19-38-40(42(36)52-41(39)30-12-5-2-6-13-30)35-16-7-8-17-37(35)51(38)34-15-9-14-33(28-34)45-49-43(31-20-24-46-25-21-31)48-44(50-45)32-22-26-47-27-23-32/h2*1-29H;1-28H
InChIKeyZMBYIEVKVVSMCK-UHFFFAOYSA-N
MW2004.30 g/mol
LogP33.73
Rot. Bonds18

About 6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole

6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole (PubChem CID 162158013) has the molecular formula C137H86N16O3 and a molecular weight of 2004.30 g/mol. Its IUPAC name is 6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole.

Molecular Properties

Compound Name6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole
PubChem CID162158013
Molecular FormulaC137H86N16O3
Molecular Weight2004.30 g/mol
Exact Mass2002.71
IUPAC Name6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole
SMILESc1ccc(-c2oc3c(ccc4c3c3ccccc3n4-c3cccc(-c4cc(-c5ccncc5)nc(-c5ccncc5)n4)c3)c2-c2ccccc2)cc1.c1ccc(-c2oc3c(ccc4c3c3ccccc3n4-c3cccc(-c4nc(-c5ccncc5)cc(-c5ccncc5)n4)c3)c2-c2ccccc2)cc1.c1ccc(-c2oc3c(ccc4c3c3ccccc3n4-c3cccc(-c4nc(-c5ccncc5)nc(-c5ccncc5)n4)c3)c2-c2ccccc2)cc1
InChIInChI=1S/2C46H29N5O.C45H28N6O/c1-3-10-32(11-4-1)42-37-18-19-41-43(45(37)52-44(42)33-12-5-2-6-13-33)36-16-7-8-17-40(36)51(41)35-15-9-14-34(28-35)46-49-38(30-20-24-47-25-21-30)29-39(50-46)31-22-26-48-27-23-31;1-3-10-31(11-4-1)42-37-18-19-41-43(45(37)52-44(42)32-12-5-2-6-13-32)36-16-7-8-17-40(36)51(41)35-15-9-14-34(28-35)39-29-38(30-20-24-47-25-21-30)49-46(50-39)33-22-26-48-27-23-33;1-3-10-29(11-4-1)39-36-18-19-38-40(42(36)52-41(39)30-12-5-2-6-13-30)35-16-7-8-17-37(35)51(38)34-15-9-14-33(28-34)45-49-43(31-20-24-46-25-21-31)48-44(50-45)32-22-26-47-27-23-32/h2*1-29H;1-28H
InChIKeyZMBYIEVKVVSMCK-UHFFFAOYSA-N
XLogP33.73
TPSA221.78 Ų
H-Bond Donors
H-Bond Acceptors19
Rotatable Bonds18
Heavy Atoms156
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002004.30
LogP ≤ 533.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1019

Analyze 6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole with MolForge

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Related Compounds

6-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole
CID 118228116
2,3-diphenyl-6-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]furo[3,2-c]carbazole
CID 118229659
6-[3-[4-(1,2-dihydropyridin-4-yl)-6-pyridin-4-yl-1,3,5-triazin-2-yl]phenyl]-2,3-diphenylfuro[3,2-c]carbazole
CID 118228574
6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2-phenyl-[1,3]oxazolo[4,5-c]carbazole
CID 123490836
6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]furo[3,2-c]carbazole
CID 118229450
5-[3-(4,6-diphenyl-2-pyridinyl)phenyl]-[1]benzofuro[3,2-c]carbazole;5-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-[1]benzofuro[3,2-c]carbazole;5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-[1]benzofuro[3,2-c]carbazole
CID 161186083
2,3-diphenyl-6-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]furo[3,2-c]carbazole
CID 118229660
2-phenyl-6-[3-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1,3]oxazolo[4,5-c]carbazole;2-phenyl-6-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-[1,3]oxazolo[4,5-c]carbazole
CID 159252427
9-[3-[6-(4-phenylphenyl)-2-(4-pyridin-4-ylphenyl)pyrimidin-4-yl]phenyl]carbazole
CID 130465926
2,3-diphenyl-6-[3-(5-phenyl-1,3,4-thiadiazol-2-yl)phenyl]furo[3,2-c]carbazole
CID 140680258
9-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]-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-[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-[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
CID 158955537
2-phenyl-6-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]-[1,3]oxazolo[4,5-c]carbazole;2-phenyl-6-[3-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-[1,3]oxazolo[4,5-c]carbazole;2-phenyl-6-[3-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]-[1,3]oxazolo[4,5-c]carbazole
CID 159545018

Frequently Asked Questions

What is the IUPAC name of 6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole?
The IUPAC name of 6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole (CID 162158013) is 6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole.
What is the SMILES notation for 6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole?
The canonical SMILES for 6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole is c1ccc(-c2oc3c(ccc4c3c3ccccc3n4-c3cccc(-c4cc(-c5ccncc5)nc(-c5ccncc5)n4)c3)c2-c2ccccc2)cc1.c1ccc(-c2oc3c(ccc4c3c3ccccc3n4-c3cccc(-c4nc(-c5ccncc5)cc(-c5ccncc5)n4)c3)c2-c2ccccc2)cc1.c1ccc(-c2oc3c(ccc4c3c3ccccc3n4-c3cccc(-c4nc(-c5ccncc5)nc(-c5ccncc5)n4)c3)c2-c2ccccc2)cc1.
What is the InChIKey of 6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole?
The InChIKey is ZMBYIEVKVVSMCK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C46H29N5O.C45H28N6O/c1-3-10-32(11-4-1)42-37-18-19-41-43(45(37)52-44(42)33-12-5-2-6-13-33)36-16-7-8-17-40(36)51(41)35-15-9-14-34(28-35)46-49-38(30-20-24-47-25-21-30)29-39(50-46)31-22-26-48-27-23-31;1-3-10-31(11-4-1)42-37-18-19-41-43(45(37)52-44(42)32-12-5-2-6-13-32)36-16-7-8-17-40(36)51(41)35-15-9-14-34(28-35)39-29-38(30-20-24-47-25-21-30)49-46(50-39)33-22-26-48-27-23-33;1-3-10-29(11-4-1)39-36-18-19-38-40(42(36)52-41(39)30-12-5-2-6-13-30)35-16-7-8-17-37(35)51(38)34-15-9-14-33(28-34)45-49-43(31-20-24-46-25-21-31)48-44(50-45)32-22-26-47-27-23-32/h2*1-29H;1-28H.
What are the key properties of 6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole?
6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole has a molecular weight of 2004.30 g/mol, XLogP of 33.73, 18 rotatable bonds, 0 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(2,6-dipyridin-4-ylpyrimidin-4-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-ylpyrimidin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole;6-[3-(4,6-dipyridin-4-yl-1,3,5-triazin-2-yl)phenyl]-2,3-diphenylfuro[3,2-c]carbazole is sourced from PubChem (CID 162158013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).