10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole

C29H19N5 — CID 139407350

IUPAC10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4n4c5ccccc5cc34)n2)cc1
InChIInChI=1S/C29H19N5/c1-3-11-20(12-4-1)27-30-28(21-13-5-2-6-14-21)32-29(31-27)34-25-18-10-9-17-24(25)33-23-16-8-7-15-22(23)19-26(33)34/h1-19H
InChIKeyBSUCIDQWTMZBEL-UHFFFAOYSA-N
MW437.51 g/mol
LogP6.56
Rot. Bonds3

About 10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole

10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole (PubChem CID 139407350) has the molecular formula C29H19N5 and a molecular weight of 437.51 g/mol. Its IUPAC name is 10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole.

Molecular Properties

Compound Name10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole
PubChem CID139407350
Molecular FormulaC29H19N5
Molecular Weight437.51 g/mol
Exact Mass437.16
IUPAC Name10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole
SMILESc1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4n4c5ccccc5cc34)n2)cc1
InChIInChI=1S/C29H19N5/c1-3-11-20(12-4-1)27-30-28(21-13-5-2-6-14-21)32-29(31-27)34-25-18-10-9-17-24(25)33-23-16-8-7-15-22(23)19-26(33)34/h1-19H
InChIKeyBSUCIDQWTMZBEL-UHFFFAOYSA-N
XLogP6.56
TPSA48.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500437.51
LogP ≤ 56.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4,6-diphenyl-1,3,5-triazin-2-yl)-2-indolo[1,2-a]benzimidazol-10-ylbenzimidazolo[1,2-a]benzimidazole
CID 139407431
10-(4-phenylquinazolin-2-yl)indolo[1,2-a]benzimidazole
CID 139407423
10-[9-(4,6-diphenylpyrimidin-2-yl)carbazol-3-yl]indolo[1,2-a]benzimidazole
CID 139407585
12-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene
CID 70836926
10-(4,6-diphenyl-1,3,5-triazin-2-yl)-7-indolo[1,2-a]benzimidazol-10-ylindolo[1,2-a]benzimidazole;10-(4-naphthalen-1-ylquinazolin-2-yl)indolo[1,2-a]benzimidazole;10-(4-naphthalen-2-ylquinazolin-2-yl)indolo[1,2-a]benzimidazole;10-(4-phenylquinazolin-2-yl)indolo[1,2-a]benzimidazole
CID 159420352
5-[10-(4,6-diphenylpyrimidin-2-yl)indolo[1,2-a]benzimidazol-7-yl]benzimidazolo[1,2-a]benzimidazole
CID 139407569
8-(4,6-diphenyl-1,3,5-triazin-2-yl)-1,8-diazahexacyclo[11.9.2.02,7.09,24.016,23.017,22]tetracosa-2,4,6,9,11,13(24),14,16(23),17,19,21-undecaene
CID 170381313
9-[4-(3-phenylphenyl)-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]carbazole
CID 146491413
7-(4,6-diphenyl-1,3,5-triazin-2-yl)benzimidazolo[1,2-a]quinazolin-5-one
CID 171448271
20-(4,6-diphenyl-1,3,5-triazin-2-yl)-20-azanonacyclo[19.16.0.02,19.04,17.05,10.011,16.023,36.024,29.030,35]heptatriaconta-1(21),2(19),3,5,7,9,11,13,15,17,22,24,26,28,30,32,34,36-octadecaene
CID 121480523
9-[4-(3-phenylphenyl)-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazin-2-yl]carbazole
CID 176831267
9-[4-carbazol-9-yl-6-[4-[3-[4-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]phenyl]-5-(3,5-diphenylphenyl)phenyl]phenyl]-1,3,5-triazin-2-yl]carbazole
CID 58943291

Frequently Asked Questions

What is the IUPAC name of 10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole?
The IUPAC name of 10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole (CID 139407350) is 10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole.
What is the SMILES notation for 10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole?
The canonical SMILES for 10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole is c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4n4c5ccccc5cc34)n2)cc1.
What is the InChIKey of 10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole?
The InChIKey is BSUCIDQWTMZBEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H19N5/c1-3-11-20(12-4-1)27-30-28(21-13-5-2-6-14-21)32-29(31-27)34-25-18-10-9-17-24(25)33-23-16-8-7-15-22(23)19-26(33)34/h1-19H.
What are the key properties of 10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole?
10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole has a molecular weight of 437.51 g/mol, XLogP of 6.56, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4,6-diphenyl-1,3,5-triazin-2-yl)indolo[1,2-a]benzimidazole is sourced from PubChem (CID 139407350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).