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

C44H28N6 — CID 129221745

IUPAC6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5cccc6c7cnccc7n(-c7ccccc7)c56)cccc43)n2)cc1
InChIInChI=1S/C44H28N6/c1-4-14-29(15-5-1)42-46-43(30-16-6-2-7-17-30)48-44(47-42)50-37-24-11-10-20-35(37)40-32(21-13-25-39(40)50)33-22-12-23-34-36-28-45-27-26-38(36)49(41(33)34)31-18-8-3-9-19-31/h1-28H
InChIKeyNHSFPVDVGBZPGC-UHFFFAOYSA-N
MW640.75 g/mol
LogP10.46
Rot. Bonds5

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

6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole (PubChem CID 129221745) has the molecular formula C44H28N6 and a molecular weight of 640.75 g/mol. Its IUPAC name is 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole.

Molecular Properties

Compound Name6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole
PubChem CID129221745
Molecular FormulaC44H28N6
Molecular Weight640.75 g/mol
Exact Mass640.24
IUPAC Name6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5cccc6c7cnccc7n(-c7ccccc7)c56)cccc43)n2)cc1
InChIInChI=1S/C44H28N6/c1-4-14-29(15-5-1)42-46-43(30-16-6-2-7-17-30)48-44(47-42)50-37-24-11-10-20-35(37)40-32(21-13-25-39(40)50)33-22-12-23-34-36-28-45-27-26-38(36)49(41(33)34)31-18-8-3-9-19-31/h1-28H
InChIKeyNHSFPVDVGBZPGC-UHFFFAOYSA-N
XLogP10.46
TPSA61.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500640.75
LogP ≤ 510.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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

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Related Compounds

5-[2-[4-phenyl-6-(4-phenylcarbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]pyrido[4,3-b]indole
CID 176634797
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
1-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-9-naphthalen-2-ylcarbazole
CID 168764938
5-[2-[4-(4-dibenzofuran-1-ylcarbazol-9-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]pyrido[4,3-b]indole
CID 176634502
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
4-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole;4-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylpyrido[4,3-b]indole;5-phenyl-4-(9-phenylcarbazol-4-yl)pyrido[4,3-b]indole;5-phenyl-4-[9-(4-phenylphenyl)carbazol-4-yl]pyrido[4,3-b]indole
CID 158225436
1-[9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]carbazol-4-yl]-9-phenylcarbazole;1-[9-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]carbazol-4-yl]-9-phenylcarbazole
CID 158026928
9-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]-4-[9-[4-phenyl-6-(2-phenylphenyl)-1,3,5-triazin-2-yl]carbazol-4-yl]carbazole
CID 176871191
5-[2-(4-carbazol-9-yl-6-phenyl-1,3,5-triazin-2-yl)phenyl]pyrido[4,3-b]indole
CID 176634765
20-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-3,6,20-triazapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene
CID 139524740
5-[2-[4-[4-(9,9-dimethylfluoren-4-yl)carbazol-9-yl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]pyrido[4,3-b]indole
CID 176634805
4-(9-phenylcarbazol-4-yl)-9-[3-[4-phenyl-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]carbazole
CID 155305706

Frequently Asked Questions

What is the IUPAC name of 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole?
The IUPAC name of 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole (CID 129221745) is 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole.
What is the SMILES notation for 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole?
The canonical SMILES for 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole is c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4c(-c5cccc6c7cnccc7n(-c7ccccc7)c56)cccc43)n2)cc1.
What is the InChIKey of 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole?
The InChIKey is NHSFPVDVGBZPGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C44H28N6/c1-4-14-29(15-5-1)42-46-43(30-16-6-2-7-17-30)48-44(47-42)50-37-24-11-10-20-35(37)40-32(21-13-25-39(40)50)33-22-12-23-34-36-28-45-27-26-38(36)49(41(33)34)31-18-8-3-9-19-31/h1-28H.
What are the key properties of 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole?
6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole has a molecular weight of 640.75 g/mol, XLogP of 10.46, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[9-(4,6-diphenyl-1,3,5-triazin-2-yl)carbazol-4-yl]-5-phenylpyrido[4,3-b]indole is sourced from PubChem (CID 129221745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).