1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine

C30H30N4 — CID 70011379

IUPAC1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine
SMILESCc1cccc2c1N(C)c1ccc(-c3ccc4c(c3)N(C)c3cccc(C)c3N4C)cc1N2C
InChIInChI=1S/C30H30N4/c1-19-9-7-11-25-29(19)33(5)23-15-13-21(17-27(23)31(25)3)22-14-16-24-28(18-22)32(4)26-12-8-10-20(2)30(26)34(24)6/h7-18H,1-6H3
InChIKeyBJFUTWZJKYMFEA-UHFFFAOYSA-N
MW446.60 g/mol
LogP7.67
Rot. Bonds1

About 1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine

1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine (PubChem CID 70011379) has the molecular formula C30H30N4 and a molecular weight of 446.60 g/mol. Its IUPAC name is 1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine.

Molecular Properties

Compound Name1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine
PubChem CID70011379
Molecular FormulaC30H30N4
Molecular Weight446.60 g/mol
Exact Mass446.25
IUPAC Name1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine
SMILESCc1cccc2c1N(C)c1ccc(-c3ccc4c(c3)N(C)c3cccc(C)c3N4C)cc1N2C
InChIInChI=1S/C30H30N4/c1-19-9-7-11-25-29(19)33(5)23-15-13-21(17-27(23)31(25)3)22-14-16-24-28(18-22)32(4)26-12-8-10-20(2)30(26)34(24)6/h7-18H,1-6H3
InChIKeyBJFUTWZJKYMFEA-UHFFFAOYSA-N
XLogP7.67
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.60
LogP ≤ 57.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine?
The IUPAC name of 1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine (CID 70011379) is 1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine.
What is the SMILES notation for 1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine?
The canonical SMILES for 1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine is Cc1cccc2c1N(C)c1ccc(-c3ccc4c(c3)N(C)c3cccc(C)c3N4C)cc1N2C.
What is the InChIKey of 1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine?
The InChIKey is BJFUTWZJKYMFEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H30N4/c1-19-9-7-11-25-29(19)33(5)23-15-13-21(17-27(23)31(25)3)22-14-16-24-28(18-22)32(4)26-12-8-10-20(2)30(26)34(24)6/h7-18H,1-6H3.
What are the key properties of 1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine?
1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine has a molecular weight of 446.60 g/mol, XLogP of 7.67, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,10-trimethyl-7-(5,6,10-trimethylphenazin-2-yl)phenazine is sourced from PubChem (CID 70011379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).