10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine

C24H20N2 — CID 142508946

IUPAC10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine
SMILESC1=CC(N2c3ccccc3Nc3ccc(-c4ccccc4)cc32)=CCC1
InChIInChI=1S/C24H20N2/c1-3-9-18(10-4-1)19-15-16-22-24(17-19)26(20-11-5-2-6-12-20)23-14-8-7-13-21(23)25-22/h1,3-5,7-17,25H,2,6H2
InChIKeyUEVBPTOORHZMDI-UHFFFAOYSA-N
MW336.44 g/mol
LogP6.78
Rot. Bonds2

About 10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine

10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine (PubChem CID 142508946) has the molecular formula C24H20N2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine.

Molecular Properties

Compound Name10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine
PubChem CID142508946
Molecular FormulaC24H20N2
Molecular Weight336.44 g/mol
Exact Mass336.16
IUPAC Name10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine
SMILESC1=CC(N2c3ccccc3Nc3ccc(-c4ccccc4)cc32)=CCC1
InChIInChI=1S/C24H20N2/c1-3-9-18(10-4-1)19-15-16-22-24(17-19)26(20-11-5-2-6-12-20)23-14-8-7-13-21(23)25-22/h1,3-5,7-17,25H,2,6H2
InChIKeyUEVBPTOORHZMDI-UHFFFAOYSA-N
XLogP6.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.44
LogP ≤ 56.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine?
The IUPAC name of 10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine (CID 142508946) is 10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine.
What is the SMILES notation for 10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine?
The canonical SMILES for 10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine is C1=CC(N2c3ccccc3Nc3ccc(-c4ccccc4)cc32)=CCC1.
What is the InChIKey of 10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine?
The InChIKey is UEVBPTOORHZMDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N2/c1-3-9-18(10-4-1)19-15-16-22-24(17-19)26(20-11-5-2-6-12-20)23-14-8-7-13-21(23)25-22/h1,3-5,7-17,25H,2,6H2.
What are the key properties of 10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine?
10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine has a molecular weight of 336.44 g/mol, XLogP of 6.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-cyclohexa-1,5-dien-1-yl-2-phenyl-5H-phenazine is sourced from PubChem (CID 142508946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).