6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile

C34H19N5O — CID 164821811

IUPAC6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile
SMILESN#Cc1cccc2oc3c(-c4nc(-c5ccccc5)nc(-n5c6ccccc6c6ccccc65)n4)cccc3c12
InChIInChI=1S/C34H19N5O/c35-20-22-12-8-19-29-30(22)25-15-9-16-26(31(25)40-29)33-36-32(21-10-2-1-3-11-21)37-34(38-33)39-27-17-6-4-13-23(27)24-14-5-7-18-28(24)39/h1-19H
InChIKeyYILBUCSRSCLMBT-UHFFFAOYSA-N
MW513.56 g/mol
LogP8.07
Rot. Bonds3

About 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile

6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile (PubChem CID 164821811) has the molecular formula C34H19N5O and a molecular weight of 513.56 g/mol. Its IUPAC name is 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile.

Molecular Properties

Compound Name6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile
PubChem CID164821811
Molecular FormulaC34H19N5O
Molecular Weight513.56 g/mol
Exact Mass513.16
IUPAC Name6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile
SMILESN#Cc1cccc2oc3c(-c4nc(-c5ccccc5)nc(-n5c6ccccc6c6ccccc65)n4)cccc3c12
InChIInChI=1S/C34H19N5O/c35-20-22-12-8-19-29-30(22)25-15-9-16-26(31(25)40-29)33-36-32(21-10-2-1-3-11-21)37-34(38-33)39-27-17-6-4-13-23(27)24-14-5-7-18-28(24)39/h1-19H
InChIKeyYILBUCSRSCLMBT-UHFFFAOYSA-N
XLogP8.07
TPSA80.53 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500513.56
LogP ≤ 58.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-[4-carbazol-9-yl-6-(3-cyanophenyl)-1,3,5-triazin-2-yl]dibenzofuran-1-carbonitrile
CID 164821782
9-[4-(9-naphthalen-1-yldibenzofuran-4-yl)-6-phenyl-1,3,5-triazin-2-yl]carbazole
CID 166952374
2-[4-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]benzonitrile
CID 148516299
9-[4-(4-dibenzofuran-4-ylphenyl)-6-phenyl-1,3,5-triazin-2-yl]carbazole
CID 146572704
9-[4-(9-dibenzofuran-2-yldibenzofuran-4-yl)-6-phenyl-1,3,5-triazin-2-yl]carbazole
CID 155357986
9-(4-dibenzofuran-1-yl-6-phenyl-1,3,5-triazin-2-yl)carbazole
CID 164821821
9-[4-[4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]carbazole
CID 155049823
9-[4-(6-dibenzofuran-3-yldibenzofuran-1-yl)-6-phenyl-1,3,5-triazin-2-yl]carbazole
CID 155358189
14-(4-dibenzofuran-4-yl-6-phenyl-1,3,5-triazin-2-yl)-9-oxa-14-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene
CID 176837448
9-[4-(9-dibenzofuran-1-yldibenzofuran-1-yl)-6-phenyl-1,3,5-triazin-2-yl]carbazole
CID 155358093
4-[8-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-yl]benzonitrile
CID 164821868
1,3-di(carbazol-9-yl)-6-(4,6-diphenyl-1,3,5-triazin-2-yl)dibenzofuran-4-carbonitrile
CID 155131785

Frequently Asked Questions

What is the IUPAC name of 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile?
The IUPAC name of 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile (CID 164821811) is 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile.
What is the SMILES notation for 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile?
The canonical SMILES for 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile is N#Cc1cccc2oc3c(-c4nc(-c5ccccc5)nc(-n5c6ccccc6c6ccccc65)n4)cccc3c12.
What is the InChIKey of 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile?
The InChIKey is YILBUCSRSCLMBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H19N5O/c35-20-22-12-8-19-29-30(22)25-15-9-16-26(31(25)40-29)33-36-32(21-10-2-1-3-11-21)37-34(38-33)39-27-17-6-4-13-23(27)24-14-5-7-18-28(24)39/h1-19H.
What are the key properties of 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile?
6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile has a molecular weight of 513.56 g/mol, XLogP of 8.07, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)dibenzofuran-1-carbonitrile is sourced from PubChem (CID 164821811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).