5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine

C34H23N5 — CID 118429493

IUPAC5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine
SMILESc1ccc(N2c3ccccc3N(c3ccccc3-n3nc4ccc5ccccc5c4n3)c3ccccc32)cc1
InChIInChI=1S/C34H23N5/c1-2-13-25(14-3-1)37-28-16-6-8-18-30(28)38(31-19-9-7-17-29(31)37)32-20-10-11-21-33(32)39-35-27-23-22-24-12-4-5-15-26(24)34(27)36-39/h1-23H
InChIKeyYZHQJRFYKXCFBL-UHFFFAOYSA-N
MW501.59 g/mol
LogP8.83
Rot. Bonds3

About 5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine

5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine (PubChem CID 118429493) has the molecular formula C34H23N5 and a molecular weight of 501.59 g/mol. Its IUPAC name is 5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine.

Molecular Properties

Compound Name5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine
PubChem CID118429493
Molecular FormulaC34H23N5
Molecular Weight501.59 g/mol
Exact Mass501.20
IUPAC Name5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine
SMILESc1ccc(N2c3ccccc3N(c3ccccc3-n3nc4ccc5ccccc5c4n3)c3ccccc32)cc1
InChIInChI=1S/C34H23N5/c1-2-13-25(14-3-1)37-28-16-6-8-18-30(28)38(31-19-9-7-17-29(31)37)32-20-10-11-21-33(32)39-35-27-23-22-24-12-4-5-15-26(24)34(27)36-39/h1-23H
InChIKeyYZHQJRFYKXCFBL-UHFFFAOYSA-N
XLogP8.83
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500501.59
LogP ≤ 58.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine?
The IUPAC name of 5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine (CID 118429493) is 5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine.
What is the SMILES notation for 5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine?
The canonical SMILES for 5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine is c1ccc(N2c3ccccc3N(c3ccccc3-n3nc4ccc5ccccc5c4n3)c3ccccc32)cc1.
What is the InChIKey of 5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine?
The InChIKey is YZHQJRFYKXCFBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H23N5/c1-2-13-25(14-3-1)37-28-16-6-8-18-30(28)38(31-19-9-7-17-29(31)37)32-20-10-11-21-33(32)39-35-27-23-22-24-12-4-5-15-26(24)34(27)36-39/h1-23H.
What are the key properties of 5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine?
5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine has a molecular weight of 501.59 g/mol, XLogP of 8.83, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-benzo[e]benzotriazol-2-ylphenyl)-10-phenylphenazine is sourced from PubChem (CID 118429493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).