2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene

C208H132 — CID 161364950

IUPAC2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene
SMILESc1cc(-c2cccc3ccccc23)cc(-c2c3ccccc3c(-c3cc4ccccc4c4ccccc34)c3ccc(-c4cccc5ccccc45)cc23)c1.c1ccc(-c2c3ccccc3c(-c3cc4ccccc4c4ccccc34)c3ccc(-c4cccc5ccccc45)cc23)c(-c2cccc3ccccc23)c1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4cc5ccccc5c5ccccc45)c4ccc(-c5cccc6ccccc56)cc34)cc2)cc1.c1ccc(-c2cccc(-c3c4ccccc4c(-c4cc5ccccc5c5ccccc45)c4ccc(-c5cccc6ccccc56)cc34)c2)cc1
InChIInChI=1S/2C54H34.2C50H32/c1-4-21-41-35(14-1)17-12-28-43(41)37-19-11-20-40(32-37)53-48-26-9-10-27-49(48)54(51-33-38-16-3-6-23-45(38)46-24-7-8-25-47(46)51)50-31-30-39(34-52(50)53)44-29-13-18-36-15-2-5-22-42(36)44;1-4-20-39-35(15-1)18-13-29-41(39)38-31-32-50-52(34-38)53(47-26-10-9-24-45(47)44-30-14-19-36-16-2-5-21-40(36)44)48-27-11-12-28-49(48)54(50)51-33-37-17-3-6-22-42(37)43-23-7-8-25-46(43)51;1-2-14-33(15-3-1)35-19-12-20-38(30-35)49-44-25-10-11-26-45(44)50(47-31-36-17-5-7-22-41(36)42-23-8-9-24-43(42)47)46-29-28-37(32-48(46)49)40-27-13-18-34-16-4-6-21-39(34)40;1-2-13-33(14-3-1)34-25-27-36(28-26-34)49-44-22-10-11-23-45(44)50(47-31-37-16-5-7-19-41(37)42-20-8-9-21-43(42)47)46-30-29-38(32-48(46)49)40-24-12-17-35-15-4-6-18-39(35)40/h2*1-34H;2*1-32H
InChIKeyVPROMJOBGCCYND-UHFFFAOYSA-N
MW2631.34 g/mol
LogP58.79
Rot. Bonds16

About 2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene

2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene (PubChem CID 161364950) has the molecular formula C208H132 and a molecular weight of 2631.34 g/mol. Its IUPAC name is 2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene.

Molecular Properties

Compound Name2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene
PubChem CID161364950
Molecular FormulaC208H132
Molecular Weight2631.34 g/mol
Exact Mass2629.03
IUPAC Name2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene
SMILESc1cc(-c2cccc3ccccc23)cc(-c2c3ccccc3c(-c3cc4ccccc4c4ccccc34)c3ccc(-c4cccc5ccccc45)cc23)c1.c1ccc(-c2c3ccccc3c(-c3cc4ccccc4c4ccccc34)c3ccc(-c4cccc5ccccc45)cc23)c(-c2cccc3ccccc23)c1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4cc5ccccc5c5ccccc45)c4ccc(-c5cccc6ccccc56)cc34)cc2)cc1.c1ccc(-c2cccc(-c3c4ccccc4c(-c4cc5ccccc5c5ccccc45)c4ccc(-c5cccc6ccccc56)cc34)c2)cc1
InChIInChI=1S/2C54H34.2C50H32/c1-4-21-41-35(14-1)17-12-28-43(41)37-19-11-20-40(32-37)53-48-26-9-10-27-49(48)54(51-33-38-16-3-6-23-45(38)46-24-7-8-25-47(46)51)50-31-30-39(34-52(50)53)44-29-13-18-36-15-2-5-22-42(36)44;1-4-20-39-35(15-1)18-13-29-41(39)38-31-32-50-52(34-38)53(47-26-10-9-24-45(47)44-30-14-19-36-16-2-5-21-40(36)44)48-27-11-12-28-49(48)54(50)51-33-37-17-3-6-22-42(37)43-23-7-8-25-46(43)51;1-2-14-33(15-3-1)35-19-12-20-38(30-35)49-44-25-10-11-26-45(44)50(47-31-36-17-5-7-22-41(36)42-23-8-9-24-43(42)47)46-29-28-37(32-48(46)49)40-27-13-18-34-16-4-6-21-39(34)40;1-2-13-33(14-3-1)34-25-27-36(28-26-34)49-44-22-10-11-23-45(44)50(47-31-37-16-5-7-19-41(37)42-20-8-9-21-43(42)47)46-30-29-38(32-48(46)49)40-24-12-17-35-15-4-6-18-39(35)40/h2*1-34H;2*1-32H
InChIKeyVPROMJOBGCCYND-UHFFFAOYSA-N
XLogP58.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms208
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002631.34
LogP ≤ 558.79
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 2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene 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 2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene?
The IUPAC name of 2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene (CID 161364950) is 2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene.
What is the SMILES notation for 2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene?
The canonical SMILES for 2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene is c1cc(-c2cccc3ccccc23)cc(-c2c3ccccc3c(-c3cc4ccccc4c4ccccc34)c3ccc(-c4cccc5ccccc45)cc23)c1.c1ccc(-c2c3ccccc3c(-c3cc4ccccc4c4ccccc34)c3ccc(-c4cccc5ccccc45)cc23)c(-c2cccc3ccccc23)c1.c1ccc(-c2ccc(-c3c4ccccc4c(-c4cc5ccccc5c5ccccc45)c4ccc(-c5cccc6ccccc56)cc34)cc2)cc1.c1ccc(-c2cccc(-c3c4ccccc4c(-c4cc5ccccc5c5ccccc45)c4ccc(-c5cccc6ccccc56)cc34)c2)cc1.
What is the InChIKey of 2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene?
The InChIKey is VPROMJOBGCCYND-UHFFFAOYSA-N. The full InChI is InChI=1S/2C54H34.2C50H32/c1-4-21-41-35(14-1)17-12-28-43(41)37-19-11-20-40(32-37)53-48-26-9-10-27-49(48)54(51-33-38-16-3-6-23-45(38)46-24-7-8-25-47(46)51)50-31-30-39(34-52(50)53)44-29-13-18-36-15-2-5-22-42(36)44;1-4-20-39-35(15-1)18-13-29-41(39)38-31-32-50-52(34-38)53(47-26-10-9-24-45(47)44-30-14-19-36-16-2-5-21-40(36)44)48-27-11-12-28-49(48)54(50)51-33-37-17-3-6-22-42(37)43-23-7-8-25-46(43)51;1-2-14-33(15-3-1)35-19-12-20-38(30-35)49-44-25-10-11-26-45(44)50(47-31-36-17-5-7-22-41(36)42-23-8-9-24-43(42)47)46-29-28-37(32-48(46)49)40-27-13-18-34-16-4-6-21-39(34)40;1-2-13-33(14-3-1)34-25-27-36(28-26-34)49-44-22-10-11-23-45(44)50(47-31-37-16-5-7-19-41(37)42-20-8-9-21-43(42)47)46-30-29-38(32-48(46)49)40-24-12-17-35-15-4-6-18-39(35)40/h2*1-34H;2*1-32H.
What are the key properties of 2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene?
2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene has a molecular weight of 2631.34 g/mol, XLogP of 58.79, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-9-(2-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-9-(3-naphthalen-1-ylphenyl)-10-phenanthren-9-ylanthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(3-phenylphenyl)anthracene;2-naphthalen-1-yl-10-phenanthren-9-yl-9-(4-phenylphenyl)anthracene is sourced from PubChem (CID 161364950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).