2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole

C172H104N20O4S6 — CID 157408380

About 2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole

2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole (PubChem CID 157408380) has the molecular formula C172H104N20O4S6 and a molecular weight of 2707.26 g/mol. Its IUPAC name is 2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole.

Molecular Properties

• Compound Name: 2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole
• PubChem CID: 157408380
• Molecular Formula: C172H104N20O4S6
• Molecular Weight: 2707.26 g/mol
• Exact Mass: 2704.69
• IUPAC Name: 2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole
• SMILES: c1ccc(-c2ccc3c(-c4ccc(-c5ncco5)nc4)c4ccccc4c(-c4ccc(-c5ncco5)nc4)c3c2)cc1.c1ccc(-c2ccc3c(-c4ccc(-c5nccs5)nc4)c4ccccc4c(-c4ccc(-c5nccs5)nc4)c3c2)cc1.c1ccc2c(-c3ccc(-c4ncco4)nc3)c3ccccc3c(-c3ccc(-c4ncco4)nc3)c2c1.c1ccc2c(-c3ccc(-c4nccs4)nc3)c3ccccc3c(-c3ccc(-c4nccs4)nc3)c2c1.c1ccc2cc(-c3ccc4c(-c5ccc(-c6nccs6)nc5)c5ccccc5c(-c5ccc(-c6nccs6)nc5)c4c3)ccc2c1
• InChI: InChI=1S/C40H24N4S2.C36H22N4O2.C36H22N4S2.C30H18N4O2.C30H18N4S2/c1-2-6-26-21-27(10-9-25(26)5-1)28-11-14-33-34(22-28)38(30-13-16-36(44-24-30)40-42-18-20-46-40)32-8-4-3-7-31(32)37(33)29-12-15-35(43-23-29)39-41-17-19-45-39;2*1-2-6-23(7-3-1)24-10-13-29-30(20-24)34(26-12-15-32(40-22-26)36-38-17-19-42-36)28-9-5-4-8-27(28)33(29)25-11-14-31(39-21-25)35-37-16-18-41-35;2*1-2-6-22-21(5-1)27(19-9-11-25(33-17-19)29-31-13-15-35-29)23-7-3-4-8-24(23)28(22)20-10-12-26(34-18-20)30-32-14-16-36-30/h1-24H;2*1-22H;2*1-18H
• InChIKey: BNZKTTDATOWJPY-UHFFFAOYSA-N
• XLogP: 46.10
• TPSA: 310.36 Ų
• H-Bond Acceptors: 30
• Rotatable Bonds: 23
• Heavy Atoms: 202
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2707.26
LogP ≤ 5	46.10
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole?

The IUPAC name of 2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole (CID 157408380) is 2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole.

What is the SMILES notation for 2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole?

The canonical SMILES for 2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole is c1ccc(-c2ccc3c(-c4ccc(-c5ncco5)nc4)c4ccccc4c(-c4ccc(-c5ncco5)nc4)c3c2)cc1.c1ccc(-c2ccc3c(-c4ccc(-c5nccs5)nc4)c4ccccc4c(-c4ccc(-c5nccs5)nc4)c3c2)cc1.c1ccc2c(-c3ccc(-c4ncco4)nc3)c3ccccc3c(-c3ccc(-c4ncco4)nc3)c2c1.c1ccc2c(-c3ccc(-c4nccs4)nc3)c3ccccc3c(-c3ccc(-c4nccs4)nc3)c2c1.c1ccc2cc(-c3ccc4c(-c5ccc(-c6nccs6)nc5)c5ccccc5c(-c5ccc(-c6nccs6)nc5)c4c3)ccc2c1.

What is the InChIKey of 2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole?

The InChIKey is BNZKTTDATOWJPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H24N4S2.C36H22N4O2.C36H22N4S2.C30H18N4O2.C30H18N4S2/c1-2-6-26-21-27(10-9-25(26)5-1)28-11-14-33-34(22-28)38(30-13-16-36(44-24-30)40-42-18-20-46-40)32-8-4-3-7-31(32)37(33)29-12-15-35(43-23-29)39-41-17-19-45-39;2*1-2-6-23(7-3-1)24-10-13-29-30(20-24)34(26-12-15-32(40-22-26)36-38-17-19-42-36)28-9-5-4-8-27(28)33(29)25-11-14-31(39-21-25)35-37-16-18-41-35;2*1-2-6-22-21(5-1)27(19-9-11-25(33-17-19)29-31-13-15-35-29)23-7-3-4-8-24(23)28(22)20-10-12-26(34-18-20)30-32-14-16-36-30/h1-24H;2*1-22H;2*1-18H.

What are the key properties of 2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole?

2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole has a molecular weight of 2707.26 g/mol, XLogP of 46.10, 23 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[5-[2-naphthalen-2-yl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[10-[6-(1,3-oxazol-2-yl)-3-pyridinyl]-2-phenylanthracen-9-yl]-2-pyridinyl]-1,3-oxazole;2-[5-[2-phenyl-10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole;2-[5-[10-[6-(1,3-thiazol-2-yl)-3-pyridinyl]anthracen-9-yl]-2-pyridinyl]-1,3-thiazole is sourced from PubChem (CID 157408380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).