9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole

C227H156N16O6 — CID 158604449

IUPAC9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole
SMILESc1ccc(-c2cnc(-c3ccc(C(c4ccccc4)(c4ccccc4)c4ccc(-c5ncc(-c6ccccc6)o5)cc4)cc3)o2)cc1.c1ccc(-c2nnc(-c3ccc(C(c4ccccc4)(c4ccccc4)c4ccc(-c5nnc(-c6ccccc6)n5-c5ccccc5)cc4)cc3)n2-c2ccccc2)cc1.c1ccc(-c2nnc(-c3ccc(C(c4ccccc4)(c4ccccc4)c4ccc(-c5nnc(-c6ccccc6)o5)cc4)cc3)o2)cc1.c1ccc(C(c2ccccc2)(c2ccc(-c3c4ccccc4nc4ccccc34)cc2)c2ccc(-c3c4ccccc4nc4ccccc34)cc2)cc1.c1ccc(C(c2ccccc2)(c2ccc(-c3nc4ccccc4o3)cc2)c2ccc(-c3nc4ccccc4o3)cc2)cc1
InChIInChI=1S/C53H38N6.C51H34N2.C43H30N2O2.C41H28N4O2.C39H26N2O2/c1-7-19-39(20-8-1)49-54-56-51(58(49)47-27-15-5-16-28-47)41-31-35-45(36-32-41)53(43-23-11-3-12-24-43,44-25-13-4-14-26-44)46-37-33-42(34-38-46)52-57-55-50(40-21-9-2-10-22-40)59(52)48-29-17-6-18-30-48;1-3-15-37(16-4-1)51(38-17-5-2-6-18-38,39-31-27-35(28-32-39)49-41-19-7-11-23-45(41)52-46-24-12-8-20-42(46)49)40-33-29-36(30-34-40)50-43-21-9-13-25-47(43)53-48-26-14-10-22-44(48)50;1-5-13-31(14-6-1)39-29-44-41(46-39)33-21-25-37(26-22-33)43(35-17-9-3-10-18-35,36-19-11-4-12-20-36)38-27-23-34(24-28-38)42-45-30-40(47-42)32-15-7-2-8-16-32;1-5-13-29(14-6-1)37-42-44-39(46-37)31-21-25-35(26-22-31)41(33-17-9-3-10-18-33,34-19-11-4-12-20-34)36-27-23-32(24-28-36)40-45-43-38(47-40)30-15-7-2-8-16-30;1-3-11-29(12-4-1)39(30-13-5-2-6-14-30,31-23-19-27(20-24-31)37-40-33-15-7-9-17-35(33)42-37)32-25-21-28(22-26-32)38-41-34-16-8-10-18-36(34)43-38/h1-38H;1-34H;1-30H;1-28H;1-26H
InChIKeyHWASIFXKKHTFIV-UHFFFAOYSA-N
MW3203.85 g/mol
LogP54.61
Rot. Bonds38

About 9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole

9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole (PubChem CID 158604449) has the molecular formula C227H156N16O6 and a molecular weight of 3203.85 g/mol. Its IUPAC name is 9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole.

Molecular Properties

Compound Name9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole
PubChem CID158604449
Molecular FormulaC227H156N16O6
Molecular Weight3203.85 g/mol
Exact Mass3201.24
IUPAC Name9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole
SMILESc1ccc(-c2cnc(-c3ccc(C(c4ccccc4)(c4ccccc4)c4ccc(-c5ncc(-c6ccccc6)o5)cc4)cc3)o2)cc1.c1ccc(-c2nnc(-c3ccc(C(c4ccccc4)(c4ccccc4)c4ccc(-c5nnc(-c6ccccc6)n5-c5ccccc5)cc4)cc3)n2-c2ccccc2)cc1.c1ccc(-c2nnc(-c3ccc(C(c4ccccc4)(c4ccccc4)c4ccc(-c5nnc(-c6ccccc6)o5)cc4)cc3)o2)cc1.c1ccc(C(c2ccccc2)(c2ccc(-c3c4ccccc4nc4ccccc34)cc2)c2ccc(-c3c4ccccc4nc4ccccc34)cc2)cc1.c1ccc(C(c2ccccc2)(c2ccc(-c3nc4ccccc4o3)cc2)c2ccc(-c3nc4ccccc4o3)cc2)cc1
InChIInChI=1S/C53H38N6.C51H34N2.C43H30N2O2.C41H28N4O2.C39H26N2O2/c1-7-19-39(20-8-1)49-54-56-51(58(49)47-27-15-5-16-28-47)41-31-35-45(36-32-41)53(43-23-11-3-12-24-43,44-25-13-4-14-26-44)46-37-33-42(34-38-46)52-57-55-50(40-21-9-2-10-22-40)59(52)48-29-17-6-18-30-48;1-3-15-37(16-4-1)51(38-17-5-2-6-18-38,39-31-27-35(28-32-39)49-41-19-7-11-23-45(41)52-46-24-12-8-20-42(46)49)40-33-29-36(30-34-40)50-43-21-9-13-25-47(43)53-48-26-14-10-22-44(48)50;1-5-13-31(14-6-1)39-29-44-41(46-39)33-21-25-37(26-22-33)43(35-17-9-3-10-18-35,36-19-11-4-12-20-36)38-27-23-34(24-28-38)42-45-30-40(47-42)32-15-7-2-8-16-32;1-5-13-29(14-6-1)37-42-44-39(46-37)31-21-25-35(26-22-31)41(33-17-9-3-10-18-33,34-19-11-4-12-20-34)36-27-23-32(24-28-36)40-45-43-38(47-40)30-15-7-2-8-16-30;1-3-11-29(12-4-1)39(30-13-5-2-6-14-30,31-23-19-27(20-24-31)37-40-33-15-7-9-17-35(33)42-37)32-25-21-28(22-26-32)38-41-34-16-8-10-18-36(34)43-38/h1-38H;1-34H;1-30H;1-28H;1-26H
InChIKeyHWASIFXKKHTFIV-UHFFFAOYSA-N
XLogP54.61
TPSA269.16 Ų
H-Bond Donors
H-Bond Acceptors22
Rotatable Bonds38
Heavy Atoms249
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003203.85
LogP ≤ 554.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1022

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole 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

Frequently Asked Questions

What is the IUPAC name of 9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole?
The IUPAC name of 9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole (CID 158604449) is 9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole.
What is the SMILES notation for 9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole?
The canonical SMILES for 9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole is c1ccc(-c2cnc(-c3ccc(C(c4ccccc4)(c4ccccc4)c4ccc(-c5ncc(-c6ccccc6)o5)cc4)cc3)o2)cc1.c1ccc(-c2nnc(-c3ccc(C(c4ccccc4)(c4ccccc4)c4ccc(-c5nnc(-c6ccccc6)n5-c5ccccc5)cc4)cc3)n2-c2ccccc2)cc1.c1ccc(-c2nnc(-c3ccc(C(c4ccccc4)(c4ccccc4)c4ccc(-c5nnc(-c6ccccc6)o5)cc4)cc3)o2)cc1.c1ccc(C(c2ccccc2)(c2ccc(-c3c4ccccc4nc4ccccc34)cc2)c2ccc(-c3c4ccccc4nc4ccccc34)cc2)cc1.c1ccc(C(c2ccccc2)(c2ccc(-c3nc4ccccc4o3)cc2)c2ccc(-c3nc4ccccc4o3)cc2)cc1.
What is the InChIKey of 9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole?
The InChIKey is HWASIFXKKHTFIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H38N6.C51H34N2.C43H30N2O2.C41H28N4O2.C39H26N2O2/c1-7-19-39(20-8-1)49-54-56-51(58(49)47-27-15-5-16-28-47)41-31-35-45(36-32-41)53(43-23-11-3-12-24-43,44-25-13-4-14-26-44)46-37-33-42(34-38-46)52-57-55-50(40-21-9-2-10-22-40)59(52)48-29-17-6-18-30-48;1-3-15-37(16-4-1)51(38-17-5-2-6-18-38,39-31-27-35(28-32-39)49-41-19-7-11-23-45(41)52-46-24-12-8-20-42(46)49)40-33-29-36(30-34-40)50-43-21-9-13-25-47(43)53-48-26-14-10-22-44(48)50;1-5-13-31(14-6-1)39-29-44-41(46-39)33-21-25-37(26-22-33)43(35-17-9-3-10-18-35,36-19-11-4-12-20-36)38-27-23-34(24-28-38)42-45-30-40(47-42)32-15-7-2-8-16-32;1-5-13-29(14-6-1)37-42-44-39(46-37)31-21-25-35(26-22-31)41(33-17-9-3-10-18-33,34-19-11-4-12-20-34)36-27-23-32(24-28-36)40-45-43-38(47-40)30-15-7-2-8-16-30;1-3-11-29(12-4-1)39(30-13-5-2-6-14-30,31-23-19-27(20-24-31)37-40-33-15-7-9-17-35(33)42-37)32-25-21-28(22-26-32)38-41-34-16-8-10-18-36(34)43-38/h1-38H;1-34H;1-30H;1-28H;1-26H.
What are the key properties of 9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole?
9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole has a molecular weight of 3203.85 g/mol, XLogP of 54.61, 38 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-[(4-acridin-9-ylphenyl)-diphenylmethyl]phenyl]acridine;2-[4-[[4-(1,3-benzoxazol-2-yl)phenyl]-diphenylmethyl]phenyl]-1,3-benzoxazole;2-[4-[diphenyl-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3,4-oxadiazole;2-[4-[diphenyl-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]methyl]phenyl]-5-phenyl-1,3-oxazole;3-[4-[[4-(4,5-diphenyl-1,2,4-triazol-3-yl)phenyl]-diphenylmethyl]phenyl]-4,5-diphenyl-1,2,4-triazole is sourced from PubChem (CID 158604449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).