9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole

C202H123N21S3 — CID 161248087

IUPAC9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole
SMILESCc1ccc2c(c1)c1ccccc1n2-c1ccccc1-c1nc(-n2c3ccccc3c3ccccc32)cc(-n2c3ccccc3c3ccccc32)n1.c1ccc2c(c1)sc1c(-c3cc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c(-n3c4ccccc4c4ccccc43)ccc12.c1ccc2c(c1)sc1c(-c3nc(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)n3)c(-n3c4ccccc4c4ccccc43)ccc12.c1ccc2c(c1)sc1c(-c3nc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c(-n3c4ccccc4c4ccccc43)ccc12
InChIInChI=1S/2C52H31N5S.C51H30N6S.C47H31N5/c1-8-22-41-32(15-1)33-16-2-9-23-42(33)55(41)47-30-29-39-38-21-7-14-28-48(38)58-51(39)50(47)40-31-49(56-43-24-10-3-17-34(43)35-18-4-11-25-44(35)56)54-52(53-40)57-45-26-12-5-19-36(45)37-20-6-13-27-46(37)57;1-8-22-40-32(15-1)33-16-2-9-23-41(33)55(40)46-30-29-39-38-21-7-14-28-47(38)58-51(39)50(46)52-53-48(56-42-24-10-3-17-34(42)35-18-4-11-25-43(35)56)31-49(54-52)57-44-26-12-5-19-36(44)37-20-6-13-27-45(37)57;1-8-22-39-31(15-1)32-16-2-9-23-40(32)55(39)45-30-29-38-37-21-7-14-28-46(37)58-48(38)47(45)49-52-50(56-41-24-10-3-17-33(41)34-18-4-11-25-42(34)56)54-51(53-49)57-43-26-12-5-19-35(43)36-20-6-13-27-44(36)57;1-30-26-27-44-37(28-30)35-18-6-8-20-38(35)50(44)43-25-13-7-19-36(43)47-48-45(51-39-21-9-2-14-31(39)32-15-3-10-22-40(32)51)29-46(49-47)52-41-23-11-4-16-33(41)34-17-5-12-24-42(34)52/h2*1-31H;1-30H;2-29H,1H3
InChIKeyVAXATEMVXLPOGQ-UHFFFAOYSA-N
MW2940.55 g/mol
LogP52.55
Rot. Bonds16

About 9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole

9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole (PubChem CID 161248087) has the molecular formula C202H123N21S3 and a molecular weight of 2940.55 g/mol. Its IUPAC name is 9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole.

Molecular Properties

Compound Name9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole
PubChem CID161248087
Molecular FormulaC202H123N21S3
Molecular Weight2940.55 g/mol
Exact Mass2937.94
IUPAC Name9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole
SMILESCc1ccc2c(c1)c1ccccc1n2-c1ccccc1-c1nc(-n2c3ccccc3c3ccccc32)cc(-n2c3ccccc3c3ccccc32)n1.c1ccc2c(c1)sc1c(-c3cc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c(-n3c4ccccc4c4ccccc43)ccc12.c1ccc2c(c1)sc1c(-c3nc(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)n3)c(-n3c4ccccc4c4ccccc43)ccc12.c1ccc2c(c1)sc1c(-c3nc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c(-n3c4ccccc4c4ccccc43)ccc12
InChIInChI=1S/2C52H31N5S.C51H30N6S.C47H31N5/c1-8-22-41-32(15-1)33-16-2-9-23-42(33)55(41)47-30-29-39-38-21-7-14-28-48(38)58-51(39)50(47)40-31-49(56-43-24-10-3-17-34(43)35-18-4-11-25-44(35)56)54-52(53-40)57-45-26-12-5-19-36(45)37-20-6-13-27-46(37)57;1-8-22-40-32(15-1)33-16-2-9-23-41(33)55(40)46-30-29-39-38-21-7-14-28-47(38)58-51(39)50(46)52-53-48(56-42-24-10-3-17-34(42)35-18-4-11-25-43(35)56)31-49(54-52)57-44-26-12-5-19-36(44)37-20-6-13-27-45(37)57;1-8-22-39-31(15-1)32-16-2-9-23-40(32)55(39)45-30-29-38-37-21-7-14-28-46(37)58-48(38)47(45)49-52-50(56-41-24-10-3-17-33(41)34-18-4-11-25-42(34)56)54-51(53-49)57-43-26-12-5-19-35(43)36-20-6-13-27-44(36)57;1-30-26-27-44-37(28-30)35-18-6-8-20-38(35)50(44)43-25-13-7-19-36(43)47-48-45(51-39-21-9-2-14-31(39)32-15-3-10-22-40(32)51)29-46(49-47)52-41-23-11-4-16-33(41)34-17-5-12-24-42(34)52/h2*1-31H;1-30H;2-29H,1H3
InChIKeyVAXATEMVXLPOGQ-UHFFFAOYSA-N
XLogP52.55
TPSA175.17 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds16
Heavy Atoms226
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002940.55
LogP ≤ 552.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole with MolForge

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Related Compounds

9-dibenzothiophen-4-yl-3-methylcarbazole
CID 90224671
9-[2-[2,6-di(carbazol-9-yl)pyrimidin-4-yl]-4,5-dimethylphenyl]-3-methylcarbazole
CID 174181953
9-[4-[4-(3-carbazol-9-yldibenzothiophen-4-yl)-6-phenyl-1,3,5-triazin-2-yl]dibenzothiophen-3-yl]carbazole
CID 153300131
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzothiophen-3-yl]carbazole
CID 118530397
3-[3-carbazol-9-yl-2-[2,6-di(carbazol-9-yl)pyrimidin-4-yl]phenyl]-9-phenylcarbazole
CID 171578191
9-[4,6-bis(3-methylcarbazol-9-yl)-1,3,5-triazin-2-yl]-3-methylcarbazole
CID 155367112
9-[4-dibenzothiophen-4-yl-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-3-(3-methylphenyl)carbazole
CID 155232875
9-[2-carbazol-9-yl-6-(2-carbazol-9-yl-6-dibenzothiophen-1-ylphenyl)pyrimidin-4-yl]-1,2,3,4,5,6,7,8-octadeuteriocarbazole
CID 171578238
5-[2-(4-dibenzothiophen-4-yl-6-naphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]benzo[b]carbazole
CID 146621086
9-[2-(2-carbazol-9-ylphenyl)phenyl]-3-methylcarbazole
CID 170201849
3,6-dimethyl-9-[2-[2-(3-methylcarbazol-9-yl)phenyl]phenyl]carbazole
CID 170060425
2-dibenzothiophen-4-yl-9-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-phenylcarbazole;2-dibenzothiophen-4-yl-9-[2-[4-phenyl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole;2-(8-phenyldibenzothiophen-4-yl)-9-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
CID 164972347

Frequently Asked Questions

What is the IUPAC name of 9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole?
The IUPAC name of 9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole (CID 161248087) is 9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole.
What is the SMILES notation for 9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole?
The canonical SMILES for 9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole is Cc1ccc2c(c1)c1ccccc1n2-c1ccccc1-c1nc(-n2c3ccccc3c3ccccc32)cc(-n2c3ccccc3c3ccccc32)n1.c1ccc2c(c1)sc1c(-c3cc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c(-n3c4ccccc4c4ccccc43)ccc12.c1ccc2c(c1)sc1c(-c3nc(-n4c5ccccc5c5ccccc54)cc(-n4c5ccccc5c5ccccc54)n3)c(-n3c4ccccc4c4ccccc43)ccc12.c1ccc2c(c1)sc1c(-c3nc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c(-n3c4ccccc4c4ccccc43)ccc12.
What is the InChIKey of 9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole?
The InChIKey is VAXATEMVXLPOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C52H31N5S.C51H30N6S.C47H31N5/c1-8-22-41-32(15-1)33-16-2-9-23-42(33)55(41)47-30-29-39-38-21-7-14-28-48(38)58-51(39)50(47)40-31-49(56-43-24-10-3-17-34(43)35-18-4-11-25-44(35)56)54-52(53-40)57-45-26-12-5-19-36(45)37-20-6-13-27-46(37)57;1-8-22-40-32(15-1)33-16-2-9-23-41(33)55(40)46-30-29-39-38-21-7-14-28-47(38)58-51(39)50(46)52-53-48(56-42-24-10-3-17-34(42)35-18-4-11-25-43(35)56)31-49(54-52)57-44-26-12-5-19-36(44)37-20-6-13-27-45(37)57;1-8-22-39-31(15-1)32-16-2-9-23-40(32)55(39)45-30-29-38-37-21-7-14-28-46(37)58-48(38)47(45)49-52-50(56-41-24-10-3-17-33(41)34-18-4-11-25-42(34)56)54-51(53-49)57-43-26-12-5-19-35(43)36-20-6-13-27-44(36)57;1-30-26-27-44-37(28-30)35-18-6-8-20-38(35)50(44)43-25-13-7-19-36(43)47-48-45(51-39-21-9-2-14-31(39)32-15-3-10-22-40(32)51)29-46(49-47)52-41-23-11-4-16-33(41)34-17-5-12-24-42(34)52/h2*1-31H;1-30H;2-29H,1H3.
What are the key properties of 9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole?
9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole has a molecular weight of 2940.55 g/mol, XLogP of 52.55, 16 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-2-yl]carbazole;9-[6-carbazol-9-yl-2-(3-carbazol-9-yldibenzothiophen-4-yl)pyrimidin-4-yl]carbazole;9-[4-carbazol-9-yl-6-(3-carbazol-9-yldibenzothiophen-4-yl)-1,3,5-triazin-2-yl]carbazole;9-[2-[4,6-di(carbazol-9-yl)pyrimidin-2-yl]phenyl]-3-methylcarbazole is sourced from PubChem (CID 161248087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).