10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine

C192H120N24O4S2 — CID 157184540

IUPAC10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)c4cc(N5c6ccccc6Oc6ccccc65)cc(N5c6ccccc6Sc6ccccc65)c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c4cc(N5c6ccccc6Oc6ccccc65)cc(N5c6ccccc6Sc6ccccc65)c4c3)n2)cc1.c1ccc(-c2nc(-c3cccnc3)cc(-c3cc(-c4cc(-c5cccnc5)nc(-c5ccccn5)n4)c4cc(N5c6ccccc6Oc6ccccc65)cc(N5c6ccccc6Oc6ccccc65)c4c3)n2)nc1
InChIInChI=1S/C66H42N6OS.C64H40N8OS.C62H38N10O2/c1-5-21-43(22-6-1)52-41-53(44-23-7-2-8-24-44)68-65(67-52)47-37-50-49(51(38-47)66-69-54(45-25-9-3-10-26-45)42-55(70-66)46-27-11-4-12-28-46)39-48(71-56-29-13-17-33-61(56)73-62-34-18-14-30-57(62)71)40-60(50)72-58-31-15-19-35-63(58)74-64-36-20-16-32-59(64)72;1-5-21-41(22-6-1)59-65-60(42-23-7-2-8-24-42)68-63(67-59)45-37-48-47(49(38-45)64-69-61(43-25-9-3-10-26-43)66-62(70-64)44-27-11-4-12-28-44)39-46(71-50-29-13-17-33-55(50)73-56-34-18-14-30-51(56)71)40-54(48)72-52-31-15-19-35-57(52)74-58-36-20-16-32-53(58)72;1-5-23-57-52(19-1)71(53-20-2-6-24-58(53)73-57)42-33-43-44(51-36-49(40-16-14-28-64-38-40)68-62(70-51)47-18-10-12-30-66-47)31-41(50-35-48(39-15-13-27-63-37-39)67-61(69-50)46-17-9-11-29-65-46)32-45(43)56(34-42)72-54-21-3-7-25-59(54)74-60-26-8-4-22-55(60)72/h1-42H;1-40H;1-38H
InChIKeyAOYSATHHZUFYJE-UHFFFAOYSA-N
MW2891.37 g/mol
LogP49.81
Rot. Bonds24

About 10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine

10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine (PubChem CID 157184540) has the molecular formula C192H120N24O4S2 and a molecular weight of 2891.37 g/mol. Its IUPAC name is 10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine.

Molecular Properties

Compound Name10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine
PubChem CID157184540
Molecular FormulaC192H120N24O4S2
Molecular Weight2891.37 g/mol
Exact Mass2888.94
IUPAC Name10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine
SMILESc1ccc(-c2cc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)c4cc(N5c6ccccc6Oc6ccccc65)cc(N5c6ccccc6Sc6ccccc65)c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c4cc(N5c6ccccc6Oc6ccccc65)cc(N5c6ccccc6Sc6ccccc65)c4c3)n2)cc1.c1ccc(-c2nc(-c3cccnc3)cc(-c3cc(-c4cc(-c5cccnc5)nc(-c5ccccn5)n4)c4cc(N5c6ccccc6Oc6ccccc65)cc(N5c6ccccc6Oc6ccccc65)c4c3)n2)nc1
InChIInChI=1S/C66H42N6OS.C64H40N8OS.C62H38N10O2/c1-5-21-43(22-6-1)52-41-53(44-23-7-2-8-24-44)68-65(67-52)47-37-50-49(51(38-47)66-69-54(45-25-9-3-10-26-45)42-55(70-66)46-27-11-4-12-28-46)39-48(71-56-29-13-17-33-61(56)73-62-34-18-14-30-57(62)71)40-60(50)72-58-31-15-19-35-63(58)74-64-36-20-16-32-59(64)72;1-5-21-41(22-6-1)59-65-60(42-23-7-2-8-24-42)68-63(67-59)45-37-48-47(49(38-45)64-69-61(43-25-9-3-10-26-43)66-62(70-64)44-27-11-4-12-28-44)39-46(71-50-29-13-17-33-55(50)73-56-34-18-14-30-51(56)71)40-54(48)72-52-31-15-19-35-57(52)74-58-36-20-16-32-53(58)72;1-5-23-57-52(19-1)71(53-20-2-6-24-58(53)73-57)42-33-43-44(51-36-49(40-16-14-28-64-38-40)68-62(70-51)47-18-10-12-30-66-47)31-41(50-35-48(39-15-13-27-63-37-39)67-61(69-50)46-17-9-11-29-65-46)32-45(43)56(34-42)72-54-21-3-7-25-59(54)74-60-26-8-4-22-55(60)72/h1-42H;1-40H;1-38H
InChIKeyAOYSATHHZUFYJE-UHFFFAOYSA-N
XLogP49.81
TPSA288.38 Ų
H-Bond Donors
H-Bond Acceptors30
Rotatable Bonds24
Heavy Atoms222
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002891.37
LogP ≤ 549.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1030

Analyze 10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-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

Related Compounds

9-[4-Carbazol-9-yl-2,6-bis(4-methylphenyl)phenyl]carbazole;9-[4-carbazol-9-yl-2,6-bis(2,3,4,5,6-pentafluorophenyl)phenyl]carbazole;10-[4-phenothiazin-10-yl-2,5-di(pyrimidin-2-yl)phenyl]phenothiazine;10-[4-phenoxazin-10-yl-2,6-bis(trifluoromethyl)phenyl]phenoxazine
CID 159440060
10-[3,5-Bis[3,5-bis(5-butylpyrimidin-2-yl)phenyl]phenyl]phenoxazine
CID 58251205
10-[3,5-Bis[3,5-di(pyrimidin-2-yl)phenyl]phenyl]phenoxazine
CID 58251210
10-[4-[5-(1,10-Phenanthrolin-2-yl)indolo[3,2-c]carbazol-12-yl]-6-phenoxazin-10-yl-1,3,5-triazin-2-yl]phenoxazine
CID 117862729
10-[3-Phenothiazin-10-yl-5-[4-phenyl-6-(4-phenylphenyl)pyrimidin-2-yl]phenyl]phenoxazine
CID 118528543
10-[3-Phenothiazin-10-yl-5-[6-phenyl-2-(4-phenylphenyl)pyrimidin-4-yl]phenyl]phenoxazine
CID 118528548
10-[2-[2,4-Di(quinazolin-5-yl)phenyl]phenyl]phenoxazine
CID 122430932
10-[3-(4,6-Diphenylpyrimidin-2-yl)phenyl]-4-[4-[2-(3-phenothiazin-10-ylphenyl)-6-phenylpyrimidin-4-yl]phenyl]phenoxazine
CID 123667916
10-[5-Phenoxazin-10-yl-3-pyrimidin-2-yl-7-(1,3,5-triazin-2-yl)naphthalen-1-yl]phenoxazine
CID 129290635
10-[5-Phenoxazin-10-yl-3,7-bis(4-pyridin-2-yl-6-pyridin-3-yl-1,3,5-triazin-2-yl)naphthalen-1-yl]phenoxazine
CID 129290644
10-[5-Phenoxazin-10-yl-3,7-bis(4-pyridin-2-yl-6-pyridin-3-ylpyrimidin-2-yl)naphthalen-1-yl]phenoxazine
CID 129290649
10-[5-Phenoxazin-10-yl-3-(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)-7-(6-pyridin-2-yl-2-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine
CID 129290650

Frequently Asked Questions

What is the IUPAC name of 10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine?
The IUPAC name of 10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine (CID 157184540) is 10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine.
What is the SMILES notation for 10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine?
The canonical SMILES for 10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine is c1ccc(-c2cc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)cc(-c5ccccc5)n4)c4cc(N5c6ccccc6Oc6ccccc65)cc(N5c6ccccc6Sc6ccccc65)c4c3)n2)cc1.c1ccc(-c2nc(-c3ccccc3)nc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c4cc(N5c6ccccc6Oc6ccccc65)cc(N5c6ccccc6Sc6ccccc65)c4c3)n2)cc1.c1ccc(-c2nc(-c3cccnc3)cc(-c3cc(-c4cc(-c5cccnc5)nc(-c5ccccn5)n4)c4cc(N5c6ccccc6Oc6ccccc65)cc(N5c6ccccc6Oc6ccccc65)c4c3)n2)nc1.
What is the InChIKey of 10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine?
The InChIKey is AOYSATHHZUFYJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H42N6OS.C64H40N8OS.C62H38N10O2/c1-5-21-43(22-6-1)52-41-53(44-23-7-2-8-24-44)68-65(67-52)47-37-50-49(51(38-47)66-69-54(45-25-9-3-10-26-45)42-55(70-66)46-27-11-4-12-28-46)39-48(71-56-29-13-17-33-61(56)73-62-34-18-14-30-57(62)71)40-60(50)72-58-31-15-19-35-63(58)74-64-36-20-16-32-59(64)72;1-5-21-41(22-6-1)59-65-60(42-23-7-2-8-24-42)68-63(67-59)45-37-48-47(49(38-45)64-69-61(43-25-9-3-10-26-43)66-62(70-64)44-27-11-4-12-28-44)39-46(71-50-29-13-17-33-55(50)73-56-34-18-14-30-51(56)71)40-54(48)72-52-31-15-19-35-57(52)74-58-36-20-16-32-53(58)72;1-5-23-57-52(19-1)71(53-20-2-6-24-58(53)73-57)42-33-43-44(51-36-49(40-16-14-28-64-38-40)68-62(70-51)47-18-10-12-30-66-47)31-41(50-35-48(39-15-13-27-63-37-39)67-61(69-50)46-17-9-11-29-65-46)32-45(43)56(34-42)72-54-21-3-7-25-59(54)74-60-26-8-4-22-55(60)72/h1-42H;1-40H;1-38H.
What are the key properties of 10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine?
10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine has a molecular weight of 2891.37 g/mol, XLogP of 49.81, 24 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[6,8-bis(4,6-diphenylpyrimidin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[6,8-bis(4,6-diphenyl-1,3,5-triazin-2-yl)-4-phenothiazin-10-ylnaphthalen-2-yl]phenoxazine;10-[3-phenoxazin-10-yl-5,7-bis(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)naphthalen-1-yl]phenoxazine is sourced from PubChem (CID 157184540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).