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

C120H78N12 — CID 159241649

IUPAC5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cccc6c5c5cccnc5n6-c5ccccc5)ccc43)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc6c5c5cccnc5n6-c5ccccc5)ccc43)n2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc5c4c4ccncc4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/C44H28N6.C41H27N3.C35H23N3/c1-4-14-29(15-5-1)41-46-42(30-16-6-2-7-17-30)48-44(47-41)50-37-23-11-10-20-34(37)36-28-31(25-26-38(36)50)33-21-12-24-39-40(33)35-22-13-27-45-43(35)49(39)32-18-8-3-9-19-32;1-3-11-28(12-4-1)29-20-23-32(24-21-29)43-37-18-8-7-15-34(37)36-27-30(22-25-38(36)43)33-16-9-19-39-40(33)35-17-10-26-42-41(35)44(39)31-13-5-2-6-14-31;1-3-10-25(11-4-1)37-31-16-8-7-14-28(31)30-22-24(18-19-32(30)37)27-15-9-17-33-35(27)29-20-21-36-23-34(29)38(33)26-12-5-2-6-13-26/h1-28H;1-27H;1-23H
InChIKeyKUEDZTXKJKQOAV-UHFFFAOYSA-N
MW1688.03 g/mol
LogP30.01
Rot. Bonds12

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

5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole (PubChem CID 159241649) has the molecular formula C120H78N12 and a molecular weight of 1688.03 g/mol. Its IUPAC name is 5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole.

Molecular Properties

Compound Name5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole
PubChem CID159241649
Molecular FormulaC120H78N12
Molecular Weight1688.03 g/mol
Exact Mass1686.65
IUPAC Name5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole
SMILESc1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cccc6c5c5cccnc5n6-c5ccccc5)ccc43)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc6c5c5cccnc5n6-c5ccccc5)ccc43)n2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc5c4c4ccncc4n5-c4ccccc4)ccc32)cc1
InChIInChI=1S/C44H28N6.C41H27N3.C35H23N3/c1-4-14-29(15-5-1)41-46-42(30-16-6-2-7-17-30)48-44(47-41)50-37-23-11-10-20-34(37)36-28-31(25-26-38(36)50)33-21-12-24-39-40(33)35-22-13-27-45-43(35)49(39)32-18-8-3-9-19-32;1-3-11-28(12-4-1)29-20-23-32(24-21-29)43-37-18-8-7-15-34(37)36-27-30(22-25-38(36)43)33-16-9-19-39-40(33)35-17-10-26-42-41(35)44(39)31-13-5-2-6-14-31;1-3-10-25(11-4-1)37-31-16-8-7-14-28(31)30-22-24(18-19-32(30)37)27-15-9-17-33-35(27)29-20-21-36-23-34(29)38(33)26-12-5-2-6-13-26/h1-28H;1-27H;1-23H
InChIKeyKUEDZTXKJKQOAV-UHFFFAOYSA-N
XLogP30.01
TPSA106.92 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds12
Heavy Atoms132
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001688.03
LogP ≤ 530.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

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

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Frequently Asked Questions

What is the IUPAC name of 5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole?
The IUPAC name of 5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole (CID 159241649) is 5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole.
What is the SMILES notation for 5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole?
The canonical SMILES for 5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole is c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5cccc6c5c5cccnc5n6-c5ccccc5)ccc43)cc2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-c5cccc6c5c5cccnc5n6-c5ccccc5)ccc43)n2)cc1.c1ccc(-n2c3ccccc3c3cc(-c4cccc5c4c4ccncc4n5-c4ccccc4)ccc32)cc1.
What is the InChIKey of 5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole?
The InChIKey is KUEDZTXKJKQOAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H28N6.C41H27N3.C35H23N3/c1-4-14-29(15-5-1)41-46-42(30-16-6-2-7-17-30)48-44(47-41)50-37-23-11-10-20-34(37)36-28-31(25-26-38(36)50)33-21-12-24-39-40(33)35-22-13-27-45-43(35)49(39)32-18-8-3-9-19-32;1-3-11-28(12-4-1)29-20-23-32(24-21-29)43-37-18-8-7-15-34(37)36-27-30(22-25-38(36)43)33-16-9-19-39-40(33)35-17-10-26-42-41(35)44(39)31-13-5-2-6-14-31;1-3-10-25(11-4-1)37-31-16-8-7-14-28(31)30-22-24(18-19-32(30)37)27-15-9-17-33-35(27)29-20-21-36-23-34(29)38(33)26-12-5-2-6-13-26/h1-28H;1-27H;1-23H.
What are the key properties of 5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole?
5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole has a molecular weight of 1688.03 g/mol, XLogP of 30.01, 12 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-3-yl]-9-phenylpyrido[2,3-b]indole;9-phenyl-5-(9-phenylcarbazol-3-yl)pyrido[3,4-b]indole;9-phenyl-5-[9-(4-phenylphenyl)carbazol-3-yl]pyrido[2,3-b]indole is sourced from PubChem (CID 159241649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).