5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole

C164H100N16O4S4 — CID 157237265

About 5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole

5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole (PubChem CID 157237265) has the molecular formula C164H100N16O4S4 and a molecular weight of 2486.98 g/mol. Its IUPAC name is 5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole.

Molecular Properties

• Compound Name: 5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole
• PubChem CID: 157237265
• Molecular Formula: C164H100N16O4S4
• Molecular Weight: 2486.98 g/mol
• Exact Mass: 2484.70
• IUPAC Name: 5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole
• SMILES: c1ccc(-c2ccccc2-c2ccc3c(-c4cncc(-c5cnco5)c4)c4ccccc4c(-c4cncc(-c5cnco5)c4)c3c2)cc1.c1ccc(-c2ccccc2-c2ccc3c(-c4cncc(-c5cncs5)c4)c4ccccc4c(-c4cncc(-c5cncs5)c4)c3c2)cc1.c1ccc2c(-c3ccc4c(-c5cncc(-c6cnco6)c5)c5ccccc5c(-c5cncc(-c6cnco6)c5)c4c3)cccc2c1.c1ccc2c(-c3ccc4c(-c5cncc(-c6cncs6)c5)c5ccccc5c(-c5cncc(-c6cncs6)c5)c4c3)cccc2c1
• InChI: InChI=1S/C42H26N4O2.C42H26N4S2.C40H24N4O2.C40H24N4S2/c2*1-2-8-27(9-3-1)33-10-4-5-11-34(33)28-14-15-37-38(18-28)42(32-17-30(20-44-22-32)40-24-46-26-48-40)36-13-7-6-12-35(36)41(37)31-16-29(19-43-21-31)39-23-45-25-47-39;2*1-2-8-31-25(6-1)7-5-11-32(31)26-12-13-35-36(16-26)40(30-15-28(18-42-20-30)38-22-44-24-46-38)34-10-4-3-9-33(34)39(35)29-14-27(17-41-19-29)37-21-43-23-45-37/h2*1-26H;2*1-24H
• InChIKey: AUUAJONDECKXNO-UHFFFAOYSA-N
• XLogP: 43.89
• TPSA: 258.80 Ų
• H-Bond Acceptors: 24
• Rotatable Bonds: 22
• Heavy Atoms: 188
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2486.98
LogP ≤ 5	43.89
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole?

The IUPAC name of 5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole (CID 157237265) is 5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole.

What is the SMILES notation for 5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole?

The canonical SMILES for 5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole is c1ccc(-c2ccccc2-c2ccc3c(-c4cncc(-c5cnco5)c4)c4ccccc4c(-c4cncc(-c5cnco5)c4)c3c2)cc1.c1ccc(-c2ccccc2-c2ccc3c(-c4cncc(-c5cncs5)c4)c4ccccc4c(-c4cncc(-c5cncs5)c4)c3c2)cc1.c1ccc2c(-c3ccc4c(-c5cncc(-c6cnco6)c5)c5ccccc5c(-c5cncc(-c6cnco6)c5)c4c3)cccc2c1.c1ccc2c(-c3ccc4c(-c5cncc(-c6cncs6)c5)c5ccccc5c(-c5cncc(-c6cncs6)c5)c4c3)cccc2c1.

What is the InChIKey of 5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole?

The InChIKey is AUUAJONDECKXNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H26N4O2.C42H26N4S2.C40H24N4O2.C40H24N4S2/c2*1-2-8-27(9-3-1)33-10-4-5-11-34(33)28-14-15-37-38(18-28)42(32-17-30(20-44-22-32)40-24-46-26-48-40)36-13-7-6-12-35(36)41(37)31-16-29(19-43-21-31)39-23-45-25-47-39;2*1-2-8-31-25(6-1)7-5-11-32(31)26-12-13-35-36(16-26)40(30-15-28(18-42-20-30)38-22-44-24-46-38)34-10-4-3-9-33(34)39(35)29-14-27(17-41-19-29)37-21-43-23-45-37/h2*1-26H;2*1-24H.

What are the key properties of 5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole?

5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole has a molecular weight of 2486.98 g/mol, XLogP of 43.89, 22 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[5-[2-naphthalen-1-yl-10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-naphthalen-1-yl-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole;5-[5-[10-[5-(1,3-oxazol-5-yl)-3-pyridinyl]-2-(2-phenylphenyl)anthracen-9-yl]-3-pyridinyl]-1,3-oxazole;5-[5-[2-(2-phenylphenyl)-10-[5-(1,3-thiazol-5-yl)-3-pyridinyl]anthracen-9-yl]-3-pyridinyl]-1,3-thiazole is sourced from PubChem (CID 157237265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).