2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran

C182H118O — CID 165025568

IUPAC2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran
SMILESc1ccc(-c2c3ccccc3c(-c3cc4ccccc4c4ccccc34)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cccc(-c4cc5ccccc5c5ccccc45)c3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cccc5ccccc45)ccc23)cc1.c1ccc(-c2ccccc2-c2c3ccccc3c(-c3ccc4c(c3)oc3ccccc34)c3ccccc23)cc1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccccc34)ccc2c1
InChIInChI=1S/C40H26.C38H24O.C36H24.2C34H22/c1-2-13-27(14-3-1)39-34-21-8-10-23-36(34)40(37-24-11-9-22-35(37)39)30-17-12-16-28(25-30)38-26-29-15-4-5-18-31(29)32-19-6-7-20-33(32)38;1-2-12-25(13-3-1)27-14-4-5-16-30(27)38-33-19-8-6-17-31(33)37(32-18-7-9-20-34(32)38)26-22-23-29-28-15-10-11-21-35(28)39-36(29)24-26;1-3-13-26(14-4-1)35-31-19-9-10-20-32(31)36(27-15-5-2-6-16-27)34-24-28(22-23-33(34)35)30-21-11-17-25-12-7-8-18-29(25)30;1-2-12-25-22-26(21-20-23(25)10-1)33-29-15-5-7-17-31(29)34(32-18-8-6-16-30(32)33)28-19-9-13-24-11-3-4-14-27(24)28;1-2-12-23(13-3-1)33-28-18-8-10-20-30(28)34(31-21-11-9-19-29(31)33)32-22-24-14-4-5-15-25(24)26-16-6-7-17-27(26)32/h1-26H;1-24H;1-24H;2*1-22H
InChIKeyLVGCEXAZBZFHHS-UHFFFAOYSA-N
MW2320.94 g/mol
LogP51.61
Rot. Bonds13

About 2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran

2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran (PubChem CID 165025568) has the molecular formula C182H118O and a molecular weight of 2320.94 g/mol. Its IUPAC name is 2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran.

Molecular Properties

Compound Name2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran
PubChem CID165025568
Molecular FormulaC182H118O
Molecular Weight2320.94 g/mol
Exact Mass2318.92
IUPAC Name2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran
SMILESc1ccc(-c2c3ccccc3c(-c3cc4ccccc4c4ccccc34)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cccc(-c4cc5ccccc5c5ccccc45)c3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cccc5ccccc45)ccc23)cc1.c1ccc(-c2ccccc2-c2c3ccccc3c(-c3ccc4c(c3)oc3ccccc34)c3ccccc23)cc1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccccc34)ccc2c1
InChIInChI=1S/C40H26.C38H24O.C36H24.2C34H22/c1-2-13-27(14-3-1)39-34-21-8-10-23-36(34)40(37-24-11-9-22-35(37)39)30-17-12-16-28(25-30)38-26-29-15-4-5-18-31(29)32-19-6-7-20-33(32)38;1-2-12-25(13-3-1)27-14-4-5-16-30(27)38-33-19-8-6-17-31(33)37(32-18-7-9-20-34(32)38)26-22-23-29-28-15-10-11-21-35(28)39-36(29)24-26;1-3-13-26(14-4-1)35-31-19-9-10-20-32(31)36(27-15-5-2-6-16-27)34-24-28(22-23-33(34)35)30-21-11-17-25-12-7-8-18-29(25)30;1-2-12-25-22-26(21-20-23(25)10-1)33-29-15-5-7-17-31(29)34(32-18-8-6-16-30(32)33)28-19-9-13-24-11-3-4-14-27(24)28;1-2-12-23(13-3-1)33-28-18-8-10-20-30(28)34(31-21-11-9-19-29(31)33)32-22-24-14-4-5-15-25(24)26-16-6-7-17-27(26)32/h1-26H;1-24H;1-24H;2*1-22H
InChIKeyLVGCEXAZBZFHHS-UHFFFAOYSA-N
XLogP51.61
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms183
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002320.94
LogP ≤ 551.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran?
The IUPAC name of 2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran (CID 165025568) is 2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran.
What is the SMILES notation for 2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran?
The canonical SMILES for 2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran is c1ccc(-c2c3ccccc3c(-c3cc4ccccc4c4ccccc34)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3cccc(-c4cc5ccccc5c5ccccc45)c3)c3ccccc23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4cccc5ccccc45)ccc23)cc1.c1ccc(-c2ccccc2-c2c3ccccc3c(-c3ccc4c(c3)oc3ccccc34)c3ccccc23)cc1.c1ccc2cc(-c3c4ccccc4c(-c4cccc5ccccc45)c4ccccc34)ccc2c1.
What is the InChIKey of 2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran?
The InChIKey is LVGCEXAZBZFHHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H26.C38H24O.C36H24.2C34H22/c1-2-13-27(14-3-1)39-34-21-8-10-23-36(34)40(37-24-11-9-22-35(37)39)30-17-12-16-28(25-30)38-26-29-15-4-5-18-31(29)32-19-6-7-20-33(32)38;1-2-12-25(13-3-1)27-14-4-5-16-30(27)38-33-19-8-6-17-31(33)37(32-18-7-9-20-34(32)38)26-22-23-29-28-15-10-11-21-35(28)39-36(29)24-26;1-3-13-26(14-4-1)35-31-19-9-10-20-32(31)36(27-15-5-2-6-16-27)34-24-28(22-23-33(34)35)30-21-11-17-25-12-7-8-18-29(25)30;1-2-12-25-22-26(21-20-23(25)10-1)33-29-15-5-7-17-31(29)34(32-18-8-6-16-30(32)33)28-19-9-13-24-11-3-4-14-27(24)28;1-2-12-23(13-3-1)33-28-18-8-10-20-30(28)34(31-21-11-9-19-29(31)33)32-22-24-14-4-5-15-25(24)26-16-6-7-17-27(26)32/h1-26H;1-24H;1-24H;2*1-22H.
What are the key properties of 2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran?
2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran has a molecular weight of 2320.94 g/mol, XLogP of 51.61, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-9,10-diphenylanthracene;9-naphthalen-1-yl-10-naphthalen-2-ylanthracene;9-phenanthren-9-yl-10-phenylanthracene;9-(3-phenanthren-9-ylphenyl)-10-phenylanthracene;3-[10-(2-phenylphenyl)anthracen-9-yl]dibenzofuran is sourced from PubChem (CID 165025568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).