9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole

C130H79N13O3 — CID 165103527

IUPAC9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole
SMILES[C-]#[N+]c1ccc(-c2cccc3c2oc2c(-c4nc(-c5ccc(-c6ccccc6)cc5)nc(-n5c6ccccc6c6ccccc65)n4)cccc23)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc5c4oc4ccc(-c6ccccc6)cc45)nc(-n4c5ccccc5c5ccccc54)n3)cc2)cc1.c1ccc(-c2ccc3oc4c(-c5nc(-c6ccccc6)nc(-n6c7ccccc7c7ccccc76)n5)cccc4c3c2)cc1
InChIInChI=1S/C46H27N5O.C45H28N4O.C39H24N4O/c1-47-33-27-25-31(26-28-33)34-15-9-16-37-38-17-10-18-39(43(38)52-42(34)37)45-48-44(32-23-21-30(22-24-32)29-11-3-2-4-12-29)49-46(50-45)51-40-19-7-5-13-35(40)36-14-6-8-20-41(36)51;1-3-12-29(13-4-1)31-22-24-32(25-23-31)43-46-44(48-45(47-43)49-39-20-9-7-16-34(39)35-17-8-10-21-40(35)49)37-19-11-18-36-38-28-33(30-14-5-2-6-15-30)26-27-41(38)50-42(36)37;1-3-12-25(13-4-1)27-22-23-35-32(24-27)30-18-11-19-31(36(30)44-35)38-40-37(26-14-5-2-6-15-26)41-39(42-38)43-33-20-9-7-16-28(33)29-17-8-10-21-34(29)43/h2-28H;1-28H;1-24H
InChIKeyYTACSPUGYFRILA-UHFFFAOYSA-N
MW1871.15 g/mol
LogP33.49
Rot. Bonds14

About 9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole

9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole (PubChem CID 165103527) has the molecular formula C130H79N13O3 and a molecular weight of 1871.15 g/mol. Its IUPAC name is 9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole.

Molecular Properties

Compound Name9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole
PubChem CID165103527
Molecular FormulaC130H79N13O3
Molecular Weight1871.15 g/mol
Exact Mass1869.64
IUPAC Name9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole
SMILES[C-]#[N+]c1ccc(-c2cccc3c2oc2c(-c4nc(-c5ccc(-c6ccccc6)cc5)nc(-n5c6ccccc6c6ccccc65)n4)cccc23)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc5c4oc4ccc(-c6ccccc6)cc45)nc(-n4c5ccccc5c5ccccc54)n3)cc2)cc1.c1ccc(-c2ccc3oc4c(-c5nc(-c6ccccc6)nc(-n6c7ccccc7c7ccccc76)n5)cccc4c3c2)cc1
InChIInChI=1S/C46H27N5O.C45H28N4O.C39H24N4O/c1-47-33-27-25-31(26-28-33)34-15-9-16-37-38-17-10-18-39(43(38)52-42(34)37)45-48-44(32-23-21-30(22-24-32)29-11-3-2-4-12-29)49-46(50-45)51-40-19-7-5-13-35(40)36-14-6-8-20-41(36)51;1-3-12-29(13-4-1)31-22-24-32(25-23-31)43-46-44(48-45(47-43)49-39-20-9-7-16-34(39)35-17-8-10-21-40(35)49)37-19-11-18-36-38-28-33(30-14-5-2-6-15-30)26-27-41(38)50-42(36)37;1-3-12-25(13-4-1)27-22-23-35-32(24-27)30-18-11-19-31(36(30)44-35)38-40-37(26-14-5-2-6-15-26)41-39(42-38)43-33-20-9-7-16-28(33)29-17-8-10-21-34(29)43/h2-28H;1-28H;1-24H
InChIKeyYTACSPUGYFRILA-UHFFFAOYSA-N
XLogP33.49
TPSA174.58 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds14
Heavy Atoms146
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001871.15
LogP ≤ 533.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole with MolForge

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Related Compounds

9-[4-(4-isocyanophenyl)-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole
CID 164821743
9-[4-phenyl-6-[4-[3-(6-phenyldibenzofuran-2-yl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole
CID 155445919
9-[4-(6-phenyldibenzofuran-2-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(6-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]carbazole
CID 164978383
9-[4-[8-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]-4-phenylcarbazole;9-[4-[8-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]carbazole;9-[4-[8-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]-2-phenylcarbazole
CID 160965442
9-[6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-2-yl]-2-phenylcarbazole
CID 163961346
9-[4-(4-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]carbazole
CID 146572704
9-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-2-(3-phenylphenyl)carbazole
CID 142377722
9-[4-(6-dibenzofuran-3-yldibenzofuran-2-yl)-6-phenyl-1,3,5-triazin-2-yl]carbazole
CID 155358310
9-[8-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]dibenzofuran-2-yl]carbazole
CID 169011410
11-(4-phenylphenyl)-12-[4-phenyl-6-(6-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(7-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(7-phenyldibenzofuran-3-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole;11-(4-phenylphenyl)-12-[4-phenyl-6-(8-phenyldibenzofuran-2-yl)-1,3,5-triazin-2-yl]indolo[2,3-a]carbazole
CID 164957984
3-dibenzofuran-2-yl-9-[4,6-di(dibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole
CID 121449444
9-[4-(4-dibenzofuran-2-yl-6-dibenzofuran-4-yl-1,3,5-triazin-2-yl)phenyl]-3-phenylcarbazole
CID 170534356

Frequently Asked Questions

What is the IUPAC name of 9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole?
The IUPAC name of 9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole (CID 165103527) is 9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole.
What is the SMILES notation for 9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole?
The canonical SMILES for 9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole is [C-]#[N+]c1ccc(-c2cccc3c2oc2c(-c4nc(-c5ccc(-c6ccccc6)cc5)nc(-n5c6ccccc6c6ccccc65)n4)cccc23)cc1.c1ccc(-c2ccc(-c3nc(-c4cccc5c4oc4ccc(-c6ccccc6)cc45)nc(-n4c5ccccc5c5ccccc54)n3)cc2)cc1.c1ccc(-c2ccc3oc4c(-c5nc(-c6ccccc6)nc(-n6c7ccccc7c7ccccc76)n5)cccc4c3c2)cc1.
What is the InChIKey of 9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole?
The InChIKey is YTACSPUGYFRILA-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H27N5O.C45H28N4O.C39H24N4O/c1-47-33-27-25-31(26-28-33)34-15-9-16-37-38-17-10-18-39(43(38)52-42(34)37)45-48-44(32-23-21-30(22-24-32)29-11-3-2-4-12-29)49-46(50-45)51-40-19-7-5-13-35(40)36-14-6-8-20-41(36)51;1-3-12-29(13-4-1)31-22-24-32(25-23-31)43-46-44(48-45(47-43)49-39-20-9-7-16-34(39)35-17-8-10-21-40(35)49)37-19-11-18-36-38-28-33(30-14-5-2-6-15-30)26-27-41(38)50-42(36)37;1-3-12-25(13-4-1)27-22-23-35-32(24-27)30-18-11-19-31(36(30)44-35)38-40-37(26-14-5-2-6-15-26)41-39(42-38)43-33-20-9-7-16-28(33)29-17-8-10-21-34(29)43/h2-28H;1-28H;1-24H.
What are the key properties of 9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole?
9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole has a molecular weight of 1871.15 g/mol, XLogP of 33.49, 14 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[6-(4-isocyanophenyl)dibenzofuran-4-yl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-(8-phenyldibenzofuran-4-yl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole;9-[4-phenyl-6-(8-phenyldibenzofuran-4-yl)-1,3,5-triazin-2-yl]carbazole is sourced from PubChem (CID 165103527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).