11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole

C33H23N5 — CID 137220792

IUPAC11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole
SMILESc1ccc(C2=NC(n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)=NCN2)cc1
InChIInChI=1S/C33H23N5/c1-3-11-22(12-4-1)32-34-21-35-33(36-32)38-29-18-10-8-16-25(29)27-20-19-26-24-15-7-9-17-28(24)37(30(26)31(27)38)23-13-5-2-6-14-23/h1-20H,21H2,(H,34,35,36)
InChIKeyDBIIYWLGZGYOTN-UHFFFAOYSA-N
MW489.58 g/mol
LogP7.10
Rot. Bonds2

About 11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole

11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole (PubChem CID 137220792) has the molecular formula C33H23N5 and a molecular weight of 489.58 g/mol. Its IUPAC name is 11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole.

Molecular Properties

Compound Name11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole
PubChem CID137220792
Molecular FormulaC33H23N5
Molecular Weight489.58 g/mol
Exact Mass489.20
IUPAC Name11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole
SMILESc1ccc(C2=NC(n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)=NCN2)cc1
InChIInChI=1S/C33H23N5/c1-3-11-22(12-4-1)32-34-21-35-33(36-32)38-29-18-10-8-16-25(29)27-20-19-26-24-15-7-9-17-28(24)37(30(26)31(27)38)23-13-5-2-6-14-23/h1-20H,21H2,(H,34,35,36)
InChIKeyDBIIYWLGZGYOTN-UHFFFAOYSA-N
XLogP7.10
TPSA46.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500489.58
LogP ≤ 57.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 118501913
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CID 145009951
12-(4-carbazol-9-ylphenyl)-11-(4-phenylphenyl)indolo[2,3-a]carbazole
CID 134252991
11-(4-phenylphenyl)-12-pyridin-3-ylindolo[2,3-a]carbazole
CID 126731374
12-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]-11-phenylindolo[2,3-a]carbazole
CID 156556541
11-[5-methyl-6-phenyl-2-(11-phenylindolo[2,3-a]carbazol-12-yl)-4,5-dihydropyrimidin-4-yl]-12-phenylindolo[2,3-a]carbazole
CID 144650039
24-phenyl-3-pyridin-2-yl-3,24-diazahexacyclo[11.11.0.02,10.04,9.014,23.016,21]tetracosa-1(13),2(10),4,6,8,11,14,16,18,20,22-undecaene
CID 122465004
11,12-bis(4-carbazol-9-ylphenyl)indolo[2,3-a]carbazole
CID 70938031
12-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-11-phenylindolo[2,3-a]carbazole
CID 118501935
12-(4,6-diphenyl-1,3,5-triazin-2-yl)-11-phenylindolo[2,3-a]carbazole;ethane
CID 160718098
11-phenyl-12-(4-phenyl-1-aza-3-azoniacyclobuta-2,3-dien-2-yl)indolo[2,3-a]carbazole
CID 163431339
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Frequently Asked Questions

What is the IUPAC name of 11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole?
The IUPAC name of 11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole (CID 137220792) is 11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole.
What is the SMILES notation for 11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole?
The canonical SMILES for 11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole is c1ccc(C2=NC(n3c4ccccc4c4ccc5c6ccccc6n(-c6ccccc6)c5c43)=NCN2)cc1.
What is the InChIKey of 11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole?
The InChIKey is DBIIYWLGZGYOTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H23N5/c1-3-11-22(12-4-1)32-34-21-35-33(36-32)38-29-18-10-8-16-25(29)27-20-19-26-24-15-7-9-17-28(24)37(30(26)31(27)38)23-13-5-2-6-14-23/h1-20H,21H2,(H,34,35,36).
What are the key properties of 11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole?
11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole has a molecular weight of 489.58 g/mol, XLogP of 7.10, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 11-phenyl-12-(6-phenyl-1,2-dihydro-1,3,5-triazin-4-yl)indolo[2,3-a]carbazole is sourced from PubChem (CID 137220792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).