5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine

C33H23N5 — CID 59194569

IUPAC5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4N(c4ccccc4)c4ccccc43)n2)cc1
InChIInChI=1S/C33H23N5/c1-4-14-24(15-5-1)31-34-32(25-16-6-2-7-17-25)36-33(35-31)38-29-22-12-10-20-27(29)37(26-18-8-3-9-19-26)28-21-11-13-23-30(28)38/h1-23H
InChIKeyGQLGPDXBQYRHEJ-UHFFFAOYSA-N
MW489.58 g/mol
LogP8.46
Rot. Bonds4

About 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine

5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine (PubChem CID 59194569) has the molecular formula C33H23N5 and a molecular weight of 489.58 g/mol. Its IUPAC name is 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine.

Molecular Properties

Compound Name5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine
PubChem CID59194569
Molecular FormulaC33H23N5
Molecular Weight489.58 g/mol
Exact Mass489.20
IUPAC Name5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine
SMILESc1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4N(c4ccccc4)c4ccccc43)n2)cc1
InChIInChI=1S/C33H23N5/c1-4-14-24(15-5-1)31-34-32(25-16-6-2-7-17-25)36-33(35-31)38-29-22-12-10-20-27(29)37(26-18-8-3-9-19-26)28-21-11-13-23-30(28)38/h1-23H
InChIKeyGQLGPDXBQYRHEJ-UHFFFAOYSA-N
XLogP8.46
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500489.58
LogP ≤ 58.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4,6-diphenyl-1,3,5-triazin-2-yl)-8,14,20,26-tetraphenyl-2,8,14,20,26-pentazahexacyclo[25.3.1.13,7.19,13.115,19.121,25]pentatriaconta-1(30),3,5,7(35),9,11,13(34),15(33),16,18,21(32),22,24,27(31),28-pentadecaene
CID 123621880
5'-(4,6-diphenylpyrimidin-2-yl)-5-phenyl-10,10'-spirobi[benzo[b][1,4]benzazagermine]
CID 153437567
10-[4-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-6-phenyl-1,3,5-triazin-2-yl]phenyl]phenoxazine
CID 118528356
10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-phenyl-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine
CID 118528442
10'-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]spiro[3,11-dioxatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene-7,9'-acridine];10'-(4,6-diphenyl-1,3,5-triazin-2-yl)spiro[3,11-dioxatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene-7,9'-acridine]
CID 162064319
5-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-10-(4,6-diphenyl-1,3,5-triazin-2-yl)phenazine
CID 154597654
4-phenyl-6-(14-phenyl-8,14-diaza-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2,4,6,9,11,13(21),15,17,19-nonaen-8-yl)-1,3,5-triazine-2-carbonitrile
CID 164931636
10-[4-[4-[4-(9,9-dimethylacridin-10-yl)phenyl]-6-(4-phenylphenyl)-1,3,5-triazin-2-yl]phenyl]-9,9-dimethylacridine
CID 118528441
5-(4,6-diphenylpyrimidin-2-yl)-10-[4-(2,6-diphenylpyrimidin-4-yl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]phenazine
CID 154597670
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-16-phenyl-12-oxa-5,16-diazahexacyclo[15.7.1.02,15.04,13.06,11.021,25]pentacosa-1(24),2,4(13),6,8,10,14,17,19,21(25),22-undecaene
CID 163774065
5-[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-10-phenylphenazine
CID 118898296
25-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-15-phenyl-8,15,25-triazaheptacyclo[14.10.1.02,7.08,27.09,14.018,26.019,24]heptacosa-1(26),2,4,6,9,11,13,16(27),17,19,21,23-dodecaene
CID 163940731

Frequently Asked Questions

What is the IUPAC name of 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine?
The IUPAC name of 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine (CID 59194569) is 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine.
What is the SMILES notation for 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine?
The canonical SMILES for 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine is c1ccc(-c2nc(-c3ccccc3)nc(N3c4ccccc4N(c4ccccc4)c4ccccc43)n2)cc1.
What is the InChIKey of 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine?
The InChIKey is GQLGPDXBQYRHEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H23N5/c1-4-14-24(15-5-1)31-34-32(25-16-6-2-7-17-25)36-33(35-31)38-29-22-12-10-20-27(29)37(26-18-8-3-9-19-26)28-21-11-13-23-30(28)38/h1-23H.
What are the key properties of 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine?
5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine has a molecular weight of 489.58 g/mol, XLogP of 8.46, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,6-diphenyl-1,3,5-triazin-2-yl)-10-phenylphenazine is sourced from PubChem (CID 59194569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).