10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine

C56H36N6O2 — CID 118532566

IUPAC10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine
SMILESc1ccc(-c2nc3c(N4c5ccccc5Oc5ccccc54)c4c(nc(-c5ccccc5)n4-c4ccccc4)c(N4c5ccccc5Oc5ccccc54)c3n2-c2ccccc2)cc1
InChIInChI=1S/C56H36N6O2/c1-5-21-37(22-6-1)55-57-49-51(59(55)39-25-9-3-10-26-39)54(62-43-31-15-19-35-47(43)64-48-36-20-16-32-44(48)62)50-52(60(40-27-11-4-12-28-40)56(58-50)38-23-7-2-8-24-38)53(49)61-41-29-13-17-33-45(41)63-46-34-18-14-30-42(46)61/h1-36H
InChIKeyYNSGFHSAIOCSOX-UHFFFAOYSA-N
MW824.94 g/mol
LogP14.85
Rot. Bonds6

About 10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine

10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine (PubChem CID 118532566) has the molecular formula C56H36N6O2 and a molecular weight of 824.94 g/mol. Its IUPAC name is 10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine.

Molecular Properties

Compound Name10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine
PubChem CID118532566
Molecular FormulaC56H36N6O2
Molecular Weight824.94 g/mol
Exact Mass824.29
IUPAC Name10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine
SMILESc1ccc(-c2nc3c(N4c5ccccc5Oc5ccccc54)c4c(nc(-c5ccccc5)n4-c4ccccc4)c(N4c5ccccc5Oc5ccccc54)c3n2-c2ccccc2)cc1
InChIInChI=1S/C56H36N6O2/c1-5-21-37(22-6-1)55-57-49-51(59(55)39-25-9-3-10-26-39)54(62-43-31-15-19-35-47(43)64-48-36-20-16-32-44(48)62)50-52(60(40-27-11-4-12-28-40)56(58-50)38-23-7-2-8-24-38)53(49)61-41-29-13-17-33-45(41)63-46-34-18-14-30-42(46)61/h1-36H
InChIKeyYNSGFHSAIOCSOX-UHFFFAOYSA-N
XLogP14.85
TPSA60.58 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500824.94
LogP ≤ 514.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine?
The IUPAC name of 10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine (CID 118532566) is 10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine.
What is the SMILES notation for 10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine?
The canonical SMILES for 10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine is c1ccc(-c2nc3c(N4c5ccccc5Oc5ccccc54)c4c(nc(-c5ccccc5)n4-c4ccccc4)c(N4c5ccccc5Oc5ccccc54)c3n2-c2ccccc2)cc1.
What is the InChIKey of 10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine?
The InChIKey is YNSGFHSAIOCSOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H36N6O2/c1-5-21-37(22-6-1)55-57-49-51(59(55)39-25-9-3-10-26-39)54(62-43-31-15-19-35-47(43)64-48-36-20-16-32-44(48)62)50-52(60(40-27-11-4-12-28-40)56(58-50)38-23-7-2-8-24-38)53(49)61-41-29-13-17-33-45(41)63-46-34-18-14-30-42(46)61/h1-36H.
What are the key properties of 10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine?
10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine has a molecular weight of 824.94 g/mol, XLogP of 14.85, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4-phenoxazin-10-yl-2,3,6,7-tetraphenylimidazo[4,5-f]benzimidazol-8-yl)phenoxazine is sourced from PubChem (CID 118532566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).