10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine

C173H118N12O3 — CID 161068023

IUPAC10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine
SMILESCc1cc(N2c3ccccc3C(c3ccccc3)(c3cc4ccccc4c4c3oc3ccccc34)c3ccccc32)c(C)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1cc(N2c3ccccc3C(c3ccccc3)(c3cc4ccccc4c4c3oc3ccccc34)c3ccccc32)cc(C)c1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1cc(N2c3ccccc3C(c3ccccc3)(c3cc4ccccc4c4c3oc3ccccc34)c3ccccc32)ccc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/2C58H40N4O.C57H38N4O/c1-37-35-51(38(2)34-45(37)57-60-55(39-20-6-3-7-21-39)59-56(61-57)40-22-8-4-9-23-40)62-49-31-17-15-29-46(49)58(42-25-10-5-11-26-42,47-30-16-18-32-50(47)62)48-36-41-24-12-13-27-43(41)53-44-28-14-19-33-52(44)63-54(48)53;1-37-34-43(35-38(2)52(37)57-60-55(39-20-6-3-7-21-39)59-56(61-57)40-22-8-4-9-23-40)62-49-31-17-15-29-46(49)58(42-25-10-5-11-26-42,47-30-16-18-32-50(47)62)48-36-41-24-12-13-27-44(41)53-45-28-14-19-33-51(45)63-54(48)53;1-37-35-42(33-34-43(37)56-59-54(38-19-5-2-6-20-38)58-55(60-56)39-21-7-3-8-22-39)61-49-30-16-14-28-46(49)57(41-24-9-4-10-25-41,47-29-15-17-31-50(47)61)48-36-40-23-11-12-26-44(40)52-45-27-13-18-32-51(45)62-53(48)52/h2*3-36H,1-2H3;2-36H,1H3
InChIKeyUEHDNHHOHPJECT-UHFFFAOYSA-N
MW2412.93 g/mol
LogP43.82
Rot. Bonds18

About 10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine

10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine (PubChem CID 161068023) has the molecular formula C173H118N12O3 and a molecular weight of 2412.93 g/mol. Its IUPAC name is 10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine.

Molecular Properties

Compound Name10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine
PubChem CID161068023
Molecular FormulaC173H118N12O3
Molecular Weight2412.93 g/mol
Exact Mass2410.94
IUPAC Name10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine
SMILESCc1cc(N2c3ccccc3C(c3ccccc3)(c3cc4ccccc4c4c3oc3ccccc34)c3ccccc32)c(C)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1cc(N2c3ccccc3C(c3ccccc3)(c3cc4ccccc4c4c3oc3ccccc34)c3ccccc32)cc(C)c1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1cc(N2c3ccccc3C(c3ccccc3)(c3cc4ccccc4c4c3oc3ccccc34)c3ccccc32)ccc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1
InChIInChI=1S/2C58H40N4O.C57H38N4O/c1-37-35-51(38(2)34-45(37)57-60-55(39-20-6-3-7-21-39)59-56(61-57)40-22-8-4-9-23-40)62-49-31-17-15-29-46(49)58(42-25-10-5-11-26-42,47-30-16-18-32-50(47)62)48-36-41-24-12-13-27-43(41)53-44-28-14-19-33-52(44)63-54(48)53;1-37-34-43(35-38(2)52(37)57-60-55(39-20-6-3-7-21-39)59-56(61-57)40-22-8-4-9-23-40)62-49-31-17-15-29-46(49)58(42-25-10-5-11-26-42,47-30-16-18-32-50(47)62)48-36-41-24-12-13-27-44(41)53-45-28-14-19-33-51(45)63-54(48)53;1-37-35-42(33-34-43(37)56-59-54(38-19-5-2-6-20-38)58-55(60-56)39-21-7-3-8-22-39)61-49-30-16-14-28-46(49)57(41-24-9-4-10-25-41,47-29-15-17-31-50(47)61)48-36-40-23-11-12-26-44(40)52-45-27-13-18-32-51(45)62-53(48)52/h2*3-36H,1-2H3;2-36H,1H3
InChIKeyUEHDNHHOHPJECT-UHFFFAOYSA-N
XLogP43.82
TPSA165.15 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds18
Heavy Atoms188
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002412.93
LogP ≤ 543.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine?
The IUPAC name of 10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine (CID 161068023) is 10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine.
What is the SMILES notation for 10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine?
The canonical SMILES for 10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine is Cc1cc(N2c3ccccc3C(c3ccccc3)(c3cc4ccccc4c4c3oc3ccccc34)c3ccccc32)c(C)cc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1cc(N2c3ccccc3C(c3ccccc3)(c3cc4ccccc4c4c3oc3ccccc34)c3ccccc32)cc(C)c1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.Cc1cc(N2c3ccccc3C(c3ccccc3)(c3cc4ccccc4c4c3oc3ccccc34)c3ccccc32)ccc1-c1nc(-c2ccccc2)nc(-c2ccccc2)n1.
What is the InChIKey of 10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine?
The InChIKey is UEHDNHHOHPJECT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C58H40N4O.C57H38N4O/c1-37-35-51(38(2)34-45(37)57-60-55(39-20-6-3-7-21-39)59-56(61-57)40-22-8-4-9-23-40)62-49-31-17-15-29-46(49)58(42-25-10-5-11-26-42,47-30-16-18-32-50(47)62)48-36-41-24-12-13-27-43(41)53-44-28-14-19-33-52(44)63-54(48)53;1-37-34-43(35-38(2)52(37)57-60-55(39-20-6-3-7-21-39)59-56(61-57)40-22-8-4-9-23-40)62-49-31-17-15-29-46(49)58(42-25-10-5-11-26-42,47-30-16-18-32-50(47)62)48-36-41-24-12-13-27-44(41)53-45-28-14-19-33-51(45)63-54(48)53;1-37-35-42(33-34-43(37)56-59-54(38-19-5-2-6-20-38)58-55(60-56)39-21-7-3-8-22-39)61-49-30-16-14-28-46(49)57(41-24-9-4-10-25-41,47-29-15-17-31-50(47)61)48-36-40-23-11-12-26-44(40)52-45-27-13-18-32-51(45)62-53(48)52/h2*3-36H,1-2H3;2-36H,1H3.
What are the key properties of 10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine?
10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine has a molecular weight of 2412.93 g/mol, XLogP of 43.82, 18 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-2,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3,5-dimethylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine;10-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-methylphenyl]-9-naphtho[2,1-b][1]benzofuran-6-yl-9-phenylacridine is sourced from PubChem (CID 161068023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).