9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole

C31H19ClN4 — CID 170111086

IUPAC9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole
SMILESClc1nc(-c2ccccc2)nc(-c2cccc3cc(-n4c5ccccc5c5ccccc54)ccc23)n1
InChIInChI=1S/C31H19ClN4/c32-31-34-29(20-9-2-1-3-10-20)33-30(35-31)26-14-8-11-21-19-22(17-18-23(21)26)36-27-15-6-4-12-24(27)25-13-5-7-16-28(25)36/h1-19H
InChIKeyFZLOTHXLOJZAAZ-UHFFFAOYSA-N
MW482.97 g/mol
LogP8.11
Rot. Bonds3

About 9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole

9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole (PubChem CID 170111086) has the molecular formula C31H19ClN4 and a molecular weight of 482.97 g/mol. Its IUPAC name is 9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole.

Molecular Properties

Compound Name9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole
PubChem CID170111086
Molecular FormulaC31H19ClN4
Molecular Weight482.97 g/mol
Exact Mass482.13
IUPAC Name9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole
SMILESClc1nc(-c2ccccc2)nc(-c2cccc3cc(-n4c5ccccc5c5ccccc54)ccc23)n1
InChIInChI=1S/C31H19ClN4/c32-31-34-29(20-9-2-1-3-10-20)33-30(35-31)26-14-8-11-21-19-22(17-18-23(21)26)36-27-15-6-4-12-24(27)25-13-5-7-16-28(25)36/h1-19H
InChIKeyFZLOTHXLOJZAAZ-UHFFFAOYSA-N
XLogP8.11
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500482.97
LogP ≤ 58.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

9-[4-(4-chloro-6-naphthalen-1-yl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 155018513
9-[5-(4-chrysen-2-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole
CID 170109199
3-(4-anthracen-9-yl-6-chloro-1,3,5-triazin-2-yl)-9-phenylcarbazole;2-(4-chloro-6-naphthalen-1-yl-1,3,5-triazin-2-yl)-9-phenylcarbazole;2-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)-9-phenanthren-2-ylcarbazole
CID 165070096
9-[3-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 166889355
5-[5-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]-12-naphthalen-2-ylindolo[3,2-c]carbazole
CID 156530949
9,12-diphenyl-16-[5-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]-12,16-diazahexacyclo[11.11.0.02,11.03,8.015,23.017,22]tetracosa-1(13),2(11),3,5,7,9,14,17,19,21,23-undecaene
CID 138654316
2-chloro-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine
CID 118688280
2,7-di(carbazol-9-yl)-9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazole
CID 146179701
9-[5-[4-naphthalen-2-yl-6-(3-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-1-yl]carbazole;9-[5-(4-naphthalen-1-yl-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole;9-[7-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]naphthalen-2-yl]carbazole
CID 165105451
9-[4-[4-[4-phenyl-6-(5-phenylnaphthalen-1-yl)-1,3,5-triazin-2-yl]naphthalen-1-yl]phenyl]carbazole
CID 176632540
9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-2-[4-(2-phenylphenyl)phenyl]carbazole
CID 170539058
2-carbazol-9-yl-9-[4-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 164807814

Frequently Asked Questions

What is the IUPAC name of 9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole?
The IUPAC name of 9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole (CID 170111086) is 9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole.
What is the SMILES notation for 9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole?
The canonical SMILES for 9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole is Clc1nc(-c2ccccc2)nc(-c2cccc3cc(-n4c5ccccc5c5ccccc54)ccc23)n1.
What is the InChIKey of 9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole?
The InChIKey is FZLOTHXLOJZAAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H19ClN4/c32-31-34-29(20-9-2-1-3-10-20)33-30(35-31)26-14-8-11-21-19-22(17-18-23(21)26)36-27-15-6-4-12-24(27)25-13-5-7-16-28(25)36/h1-19H.
What are the key properties of 9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole?
9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole has a molecular weight of 482.97 g/mol, XLogP of 8.11, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[5-(4-chloro-6-phenyl-1,3,5-triazin-2-yl)naphthalen-2-yl]carbazole is sourced from PubChem (CID 170111086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).