6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole

C118H76N12 — CID 157480501

IUPAC6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccncc5n6-c5ccccc5)ccc43)n2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cnccc4n5-c4ccccc4)ccc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5ccccc5c4)ccc32)cc1
InChIInChI=1S/C44H28N6.C39H25N3.C35H23N3/c1-4-12-29(13-5-1)42-46-43(30-14-6-2-7-15-30)48-44(47-42)50-38-19-11-10-18-34(38)36-26-32(21-23-40(36)50)31-20-22-39-37(27-31)35-24-25-45-28-41(35)49(39)33-16-8-3-9-17-33;1-2-10-30(11-3-1)41-38-19-16-29(24-34(38)35-25-40-21-20-39(35)41)28-15-18-37-33(23-28)32-12-6-7-13-36(32)42(37)31-17-14-26-8-4-5-9-27(26)22-31;1-3-9-26(10-4-1)37-32-14-8-7-13-28(32)29-21-24(15-17-33(29)37)25-16-18-34-30(22-25)31-23-36-20-19-35(31)38(34)27-11-5-2-6-12-27/h1-28H;1-25H;1-23H
InChIKeyBWCJJYGUMJFPPZ-UHFFFAOYSA-N
MW1661.99 g/mol
LogP29.50
Rot. Bonds11

About 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole

6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole (PubChem CID 157480501) has the molecular formula C118H76N12 and a molecular weight of 1661.99 g/mol. Its IUPAC name is 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole.

Molecular Properties

Compound Name6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole
PubChem CID157480501
Molecular FormulaC118H76N12
Molecular Weight1661.99 g/mol
Exact Mass1660.63
IUPAC Name6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccncc5n6-c5ccccc5)ccc43)n2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cnccc4n5-c4ccccc4)ccc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5ccccc5c4)ccc32)cc1
InChIInChI=1S/C44H28N6.C39H25N3.C35H23N3/c1-4-12-29(13-5-1)42-46-43(30-14-6-2-7-15-30)48-44(47-42)50-38-19-11-10-18-34(38)36-26-32(21-23-40(36)50)31-20-22-39-37(27-31)35-24-25-45-28-41(35)49(39)33-16-8-3-9-17-33;1-2-10-30(11-3-1)41-38-19-16-29(24-34(38)35-25-40-21-20-39(35)41)28-15-18-37-33(23-28)32-12-6-7-13-36(32)42(37)31-17-14-26-8-4-5-9-27(26)22-31;1-3-9-26(10-4-1)37-32-14-8-7-13-28(32)29-21-24(15-17-33(29)37)25-16-18-34-30(22-25)31-23-36-20-19-35(31)38(34)27-11-5-2-6-12-27/h1-28H;1-25H;1-23H
InChIKeyBWCJJYGUMJFPPZ-UHFFFAOYSA-N
XLogP29.50
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds11
Heavy Atoms130
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001661.99
LogP ≤ 529.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole with MolForge

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Related Compounds

6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-2-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-2-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-2-yl)pyrido[4,3-b]indole;5-phenyl-8-[9-(4-phenylphenyl)carbazol-2-yl]pyrido[4,3-b]indole
CID 158478880
9-[3-[4,6-bis[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]pyrido[3,4-b]indole
CID 139554443
7-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole;7-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-7-(9-phenylcarbazol-4-yl)pyrido[4,3-b]indole;5-phenyl-7-[9-(4-phenylphenyl)carbazol-4-yl]pyrido[4,3-b]indole
CID 160562626
6-[4-(9-phenylcarbazol-3-yl)phenyl]-9-(4-phenylphenyl)pyrido[3,4-b]indole
CID 90336700
6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-9-phenylpyrido[3,4-b]indole;9-phenyl-6-[9-(4-phenylphenyl)carbazol-4-yl]pyrido[3,4-b]indole
CID 161163383
3-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]phenyl]-9-pyridin-4-ylcarbazole
CID 118487847
5-phenyl-8-[9-(3-phenylphenyl)pyrido[3,4-b]indol-6-yl]pyrido[4,3-b]indole
CID 90336649
8-[4-(3-carbazol-9-ylcarbazol-9-yl)phenyl]-5-phenylpyrido[4,3-b]indole
CID 170060405
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
3-[4-(4-carbazol-9-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]-9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazole
CID 146573156
8-carbazol-9-yl-5-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]pyrido[4,3-b]indole
CID 135252602
3,6-bis(9-phenylcarbazol-3-yl)-9-[3-(4-phenyl-6-pyridin-4-yl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 118699027

Frequently Asked Questions

What is the IUPAC name of 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole?
The IUPAC name of 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole (CID 157480501) is 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole.
What is the SMILES notation for 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole?
The canonical SMILES for 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole is c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5ccc6c(c5)c5ccncc5n6-c5ccccc5)ccc43)n2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4ccc5c(c4)c4cnccc4n5-c4ccccc4)ccc32)cc1.c1ccc(-n2c3ccncc3c3cc(-c4ccc5c(c4)c4ccccc4n5-c4ccc5ccccc5c4)ccc32)cc1.
What is the InChIKey of 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole?
The InChIKey is BWCJJYGUMJFPPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H28N6.C39H25N3.C35H23N3/c1-4-12-29(13-5-1)42-46-43(30-14-6-2-7-15-30)48-44(47-42)50-38-19-11-10-18-34(38)36-26-32(21-23-40(36)50)31-20-22-39-37(27-31)35-24-25-45-28-41(35)49(39)33-16-8-3-9-17-33;1-2-10-30(11-3-1)41-38-19-16-29(24-34(38)35-25-40-21-20-39(35)41)28-15-18-37-33(23-28)32-12-6-7-13-36(32)42(37)31-17-14-26-8-4-5-9-27(26)22-31;1-3-9-26(10-4-1)37-32-14-8-7-13-28(32)29-21-24(15-17-33(29)37)25-16-18-34-30(22-25)31-23-36-20-19-35(31)38(34)27-11-5-2-6-12-27/h1-28H;1-25H;1-23H.
What are the key properties of 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole?
6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole has a molecular weight of 1661.99 g/mol, XLogP of 29.50, 11 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[3,4-b]indole;8-(9-naphthalen-2-ylcarbazol-3-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-8-(9-phenylcarbazol-3-yl)pyrido[4,3-b]indole is sourced from PubChem (CID 157480501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).