10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine

C28H18N4O — CID 118457777

IUPAC10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine
SMILESc1ccc2c(c1)Oc1ccccc1N2c1cncc(-n2c3ccccc3c3ccccc32)n1
InChIInChI=1S/C28H18N4O/c1-3-11-21-19(9-1)20-10-2-4-12-22(20)31(21)27-17-29-18-28(30-27)32-23-13-5-7-15-25(23)33-26-16-8-6-14-24(26)32/h1-18H
InChIKeyKAIJCZSKFVHWMT-UHFFFAOYSA-N
MW426.48 g/mol
LogP7.15
Rot. Bonds2

About 10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine

10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine (PubChem CID 118457777) has the molecular formula C28H18N4O and a molecular weight of 426.48 g/mol. Its IUPAC name is 10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine.

Molecular Properties

Compound Name10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine
PubChem CID118457777
Molecular FormulaC28H18N4O
Molecular Weight426.48 g/mol
Exact Mass426.15
IUPAC Name10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine
SMILESc1ccc2c(c1)Oc1ccccc1N2c1cncc(-n2c3ccccc3c3ccccc32)n1
InChIInChI=1S/C28H18N4O/c1-3-11-21-19(9-1)20-10-2-4-12-22(20)31(21)27-17-29-18-28(30-27)32-23-13-5-7-15-25(23)33-26-16-8-6-14-24(26)32/h1-18H
InChIKeyKAIJCZSKFVHWMT-UHFFFAOYSA-N
XLogP7.15
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.48
LogP ≤ 57.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine?
The IUPAC name of 10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine (CID 118457777) is 10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine.
What is the SMILES notation for 10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine?
The canonical SMILES for 10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine is c1ccc2c(c1)Oc1ccccc1N2c1cncc(-n2c3ccccc3c3ccccc32)n1.
What is the InChIKey of 10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine?
The InChIKey is KAIJCZSKFVHWMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H18N4O/c1-3-11-21-19(9-1)20-10-2-4-12-22(20)31(21)27-17-29-18-28(30-27)32-23-13-5-7-15-25(23)33-26-16-8-6-14-24(26)32/h1-18H.
What are the key properties of 10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine?
10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine has a molecular weight of 426.48 g/mol, XLogP of 7.15, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(6-carbazol-9-ylpyrazin-2-yl)phenoxazine is sourced from PubChem (CID 118457777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).