9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene

C182H114 — CID 159027158

IUPAC9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene
SMILESc1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccc5ccccc5c4)ccc23)cc1.c1ccc2c(-c3ccc4c(-c5ccc6c7ccccc7c7ccccc7c6c5)c5ccccc5c(-c5ccc6ccc7cccc8ccc5c6c78)c4c3)cccc2c1.c1ccc2cc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)ccc2c1.c1ccc2cc(-c3ccc4c(-c5cccc6ccccc56)c5ccccc5c(-c5cccc6ccccc56)c4c3)ccc2c1
InChIInChI=1S/C58H34.2C44H28.C36H24/c1-2-15-41-35(11-1)12-10-22-42(41)39-27-32-52-54(33-39)58(51-31-26-38-24-23-36-13-9-14-37-25-30-50(51)57(38)55(36)37)49-21-8-7-20-48(49)56(52)40-28-29-47-45-18-4-3-16-43(45)44-17-5-6-19-46(44)53(47)34-40;1-4-12-32-25-35(20-17-29(32)9-1)36-23-24-41-42(28-36)44(38-22-19-31-11-3-6-14-34(31)27-38)40-16-8-7-15-39(40)43(41)37-21-18-30-10-2-5-13-33(30)26-37;1-2-14-32-27-33(24-23-29(32)11-1)34-25-26-41-42(28-34)44(38-22-10-16-31-13-4-6-18-36(31)38)40-20-8-7-19-39(40)43(41)37-21-9-15-30-12-3-5-17-35(30)37;1-3-12-26(13-4-1)35-31-17-9-10-18-32(31)36(27-14-5-2-6-15-27)34-24-30(21-22-33(34)35)29-20-19-25-11-7-8-16-28(25)23-29/h1-34H;2*1-28H;1-24H
InChIKeyJUKOVMWCHJLNCS-UHFFFAOYSA-N
MW2300.91 g/mol
LogP51.56
Rot. Bonds12

About 9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene

9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene (PubChem CID 159027158) has the molecular formula C182H114 and a molecular weight of 2300.91 g/mol. Its IUPAC name is 9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene.

Molecular Properties

Compound Name9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene
PubChem CID159027158
Molecular FormulaC182H114
Molecular Weight2300.91 g/mol
Exact Mass2298.89
IUPAC Name9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene
SMILESc1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccc5ccccc5c4)ccc23)cc1.c1ccc2c(-c3ccc4c(-c5ccc6c7ccccc7c7ccccc7c6c5)c5ccccc5c(-c5ccc6ccc7cccc8ccc5c6c78)c4c3)cccc2c1.c1ccc2cc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)ccc2c1.c1ccc2cc(-c3ccc4c(-c5cccc6ccccc56)c5ccccc5c(-c5cccc6ccccc56)c4c3)ccc2c1
InChIInChI=1S/C58H34.2C44H28.C36H24/c1-2-15-41-35(11-1)12-10-22-42(41)39-27-32-52-54(33-39)58(51-31-26-38-24-23-36-13-9-14-37-25-30-50(51)57(38)55(36)37)49-21-8-7-20-48(49)56(52)40-28-29-47-45-18-4-3-16-43(45)44-17-5-6-19-46(44)53(47)34-40;1-4-12-32-25-35(20-17-29(32)9-1)36-23-24-41-42(28-36)44(38-22-19-31-11-3-6-14-34(31)27-38)40-16-8-7-15-39(40)43(41)37-21-18-30-10-2-5-13-33(30)26-37;1-2-14-32-27-33(24-23-29(32)11-1)34-25-26-41-42(28-34)44(38-22-10-16-31-13-4-6-18-36(31)38)40-20-8-7-19-39(40)43(41)37-21-9-15-30-12-3-5-17-35(30)37;1-3-12-26(13-4-1)35-31-17-9-10-18-32(31)36(27-14-5-2-6-15-27)34-24-30(21-22-33(34)35)29-20-19-25-11-7-8-16-28(25)23-29/h1-34H;2*1-28H;1-24H
InChIKeyJUKOVMWCHJLNCS-UHFFFAOYSA-N
XLogP51.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms182
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002300.91
LogP ≤ 551.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene?
The IUPAC name of 9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene (CID 159027158) is 9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene.
What is the SMILES notation for 9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene?
The canonical SMILES for 9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene is c1ccc(-c2c3ccccc3c(-c3ccccc3)c3cc(-c4ccc5ccccc5c4)ccc23)cc1.c1ccc2c(-c3ccc4c(-c5ccc6c7ccccc7c7ccccc7c6c5)c5ccccc5c(-c5ccc6ccc7cccc8ccc5c6c78)c4c3)cccc2c1.c1ccc2cc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)ccc2c1.c1ccc2cc(-c3ccc4c(-c5cccc6ccccc56)c5ccccc5c(-c5cccc6ccccc56)c4c3)ccc2c1.
What is the InChIKey of 9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene?
The InChIKey is JUKOVMWCHJLNCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H34.2C44H28.C36H24/c1-2-15-41-35(11-1)12-10-22-42(41)39-27-32-52-54(33-39)58(51-31-26-38-24-23-36-13-9-14-37-25-30-50(51)57(38)55(36)37)49-21-8-7-20-48(49)56(52)40-28-29-47-45-18-4-3-16-43(45)44-17-5-6-19-46(44)53(47)34-40;1-4-12-32-25-35(20-17-29(32)9-1)36-23-24-41-42(28-36)44(38-22-19-31-11-3-6-14-34(31)27-38)40-16-8-7-15-39(40)43(41)37-21-18-30-10-2-5-13-33(30)26-37;1-2-14-32-27-33(24-23-29(32)11-1)34-25-26-41-42(28-34)44(38-22-10-16-31-13-4-6-18-36(31)38)40-20-8-7-19-39(40)43(41)37-21-9-15-30-12-3-5-17-35(30)37;1-3-12-26(13-4-1)35-31-17-9-10-18-32(31)36(27-14-5-2-6-15-27)34-24-30(21-22-33(34)35)29-20-19-25-11-7-8-16-28(25)23-29/h1-34H;2*1-28H;1-24H.
What are the key properties of 9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene?
9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene has a molecular weight of 2300.91 g/mol, XLogP of 51.56, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dinaphthalen-1-yl-2-naphthalen-2-ylanthracene;2-naphthalen-2-yl-9,10-diphenylanthracene;2-(3-naphthalen-1-yl-10-pyren-1-ylanthracen-9-yl)triphenylene;2,9,10-trinaphthalen-2-ylanthracene is sourced from PubChem (CID 159027158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).