2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine

C189H129N19S3Si — CID 157476412

About 2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine

2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine (PubChem CID 157476412) has the molecular formula C189H129N19S3Si and a molecular weight of 2790.53 g/mol. Its IUPAC name is 2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine.

Molecular Properties

• Compound Name: 2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine
• PubChem CID: 157476412
• Molecular Formula: C189H129N19S3Si
• Molecular Weight: 2790.53 g/mol
• Exact Mass: 2787.96
• IUPAC Name: 2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine
• SMILES: c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2cc(N(c3ccc(-c4ccncc4)cc3)c3ccc(-c4ccccn4)cc3)cc(N3c4ccccc4Sc4ccccc43)n2)cc1.c1ccc(C2(c3ccccc3)c3ccccc3N(c3cc(N(c4ccc(-c5ccncc5)cc4)c4ccc(-c5ccccn5)cc4)cc(N4c5ccccc5Sc5ccccc54)n3)c3ccccc32)cc1.c1ccc([Si]2(c3ccccc3)c3ccccc3N(c3cc(N(c4ccc(-c5ccncc5)cc4)c4ccc(-c5cncnc5)cc4)cc(N4c5ccccc5Sc5ccccc54)n3)c3ccccc32)cc1
• InChI: InChI=1S/C64H44N6S.C63H42N6S.C62H43N7SSi/c1-3-17-48(18-4-1)64(49-19-5-2-6-20-49)53-21-7-9-24-56(53)69(57-25-10-8-22-54(57)64)62-43-52(44-63(67-62)70-58-26-11-13-28-60(58)71-61-29-14-12-27-59(61)70)68(50-34-30-45(31-35-50)46-38-41-65-42-39-46)51-36-32-47(33-37-51)55-23-15-16-40-66-55;1-3-13-43(14-4-1)48-26-32-56-53(39-48)54-40-49(44-15-5-2-6-16-44)27-33-57(54)68(56)62-41-52(42-63(66-62)69-58-18-7-9-20-60(58)70-61-21-10-8-19-59(61)69)67(50-28-22-45(23-29-50)46-34-37-64-38-35-46)51-30-24-47(25-31-51)55-17-11-12-36-65-55;1-3-15-51(16-4-1)71(52-17-5-2-6-18-52)59-25-13-9-21-55(59)69(56-22-10-14-26-60(56)71)62-40-50(39-61(66-62)68-53-19-7-11-23-57(53)70-58-24-12-8-20-54(58)68)67(48-31-27-44(28-32-48)46-35-37-63-38-36-46)49-33-29-45(30-34-49)47-41-64-43-65-42-47/h1-44H;1-42H;1-43H
• InChIKey: BVQIHAFSSWSUBP-UHFFFAOYSA-N
• XLogP: 46.98
• TPSA: 159.75 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 27
• Heavy Atoms: 212
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2790.53
LogP ≤ 5	46.98
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine?

The IUPAC name of 2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine (CID 157476412) is 2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine.

What is the SMILES notation for 2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine?

The canonical SMILES for 2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine is c1ccc(-c2ccc3c(c2)c2cc(-c4ccccc4)ccc2n3-c2cc(N(c3ccc(-c4ccncc4)cc3)c3ccc(-c4ccccn4)cc3)cc(N3c4ccccc4Sc4ccccc43)n2)cc1.c1ccc(C2(c3ccccc3)c3ccccc3N(c3cc(N(c4ccc(-c5ccncc5)cc4)c4ccc(-c5ccccn5)cc4)cc(N4c5ccccc5Sc5ccccc54)n3)c3ccccc32)cc1.c1ccc([Si]2(c3ccccc3)c3ccccc3N(c3cc(N(c4ccc(-c5ccncc5)cc4)c4ccc(-c5cncnc5)cc4)cc(N4c5ccccc5Sc5ccccc54)n3)c3ccccc32)cc1.

What is the InChIKey of 2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine?

The InChIKey is BVQIHAFSSWSUBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H44N6S.C63H42N6S.C62H43N7SSi/c1-3-17-48(18-4-1)64(49-19-5-2-6-20-49)53-21-7-9-24-56(53)69(57-25-10-8-22-54(57)64)62-43-52(44-63(67-62)70-58-26-11-13-28-60(58)71-61-29-14-12-27-59(61)70)68(50-34-30-45(31-35-50)46-38-41-65-42-39-46)51-36-32-47(33-37-51)55-23-15-16-40-66-55;1-3-13-43(14-4-1)48-26-32-56-53(39-48)54-40-49(44-15-5-2-6-16-44)27-33-57(54)68(56)62-41-52(42-63(66-62)69-58-18-7-9-20-60(58)70-61-21-10-8-19-59(61)69)67(50-28-22-45(23-29-50)46-34-37-64-38-35-46)51-30-24-47(25-31-51)55-17-11-12-36-65-55;1-3-15-51(16-4-1)71(52-17-5-2-6-18-52)59-25-13-9-21-55(59)69(56-22-10-14-26-60(56)71)62-40-50(39-61(66-62)68-53-19-7-11-23-57(53)70-58-24-12-8-20-54(58)68)67(48-31-27-44(28-32-48)46-35-37-63-38-36-46)49-33-29-45(30-34-49)47-41-64-43-65-42-47/h1-44H;1-42H;1-43H.

What are the key properties of 2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine?

2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine has a molecular weight of 2790.53 g/mol, XLogP of 46.98, 27 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(9,9-diphenylacridin-10-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine;2-(10,10-diphenylbenzo[b][1,4]benzazasilin-5-yl)-6-phenothiazin-10-yl-N-(4-pyridin-4-ylphenyl)-N-(4-pyrimidin-5-ylphenyl)pyridin-4-amine;2-(3,6-diphenylcarbazol-9-yl)-6-phenothiazin-10-yl-N-(4-pyridin-2-ylphenyl)-N-(4-pyridin-4-ylphenyl)pyridin-4-amine is sourced from PubChem (CID 157476412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).