2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum

C164H108N18O4Pt4-4 — CID 158213354

About 2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum

2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum (PubChem CID 158213354) has the molecular formula C164H108N18O4Pt4-4 and a molecular weight of 3175.10 g/mol. Its IUPAC name is 2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum.

Molecular Properties

• Compound Name: 2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum
• PubChem CID: 158213354
• Molecular Formula: C164H108N18O4Pt4-4
• Molecular Weight: 3175.10 g/mol
• Exact Mass: 3172.74
• IUPAC Name: 2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum
• SMILES: Oc1ccccc1-c1cc(-c2ccccc2)nc(-c2[c-]c(N(c3cc4ccccc4cn3)c3cccc4ccccc34)ccc2)n1.Oc1ccccc1-c1nc(-c2[c-]c(N(c3cc(-c4ccccc4)ccn3)c3cccc4ccccc34)ccc2)nc(-c2ccccc2)n1.Oc1ccccc1-c1nc(-c2[c-]c(N(c3cccc4ccccc34)c3nccc4ccccc34)ccc2)cnc1-c1ccccc1.Oc1ccccc1-c1nc(-c2[c-]c(N(c3cccc4ccccc34)c3nccc4ccccc34)ccc2)nc(-c2ccccc2)n1.[Pt].[Pt].[Pt].[Pt]
• InChI: InChI=1S/C42H28N5O.2C41H27N4O.C40H26N5O.4Pt/c48-38-24-10-9-22-36(38)42-45-40(31-16-5-2-6-17-31)44-41(46-42)33-19-11-20-34(27-33)47(37-23-12-18-30-15-7-8-21-35(30)37)39-28-32(25-26-43-39)29-13-3-1-4-14-29;46-38-23-9-8-21-35(38)40-39(30-14-2-1-3-15-30)43-27-36(44-40)31-17-10-18-32(26-31)45(37-22-11-16-28-12-4-6-19-33(28)37)41-34-20-7-5-13-29(34)24-25-42-41;46-39-23-9-8-21-35(39)37-26-36(29-13-2-1-3-14-29)43-41(44-37)31-18-10-19-33(24-31)45(38-22-11-17-28-12-6-7-20-34(28)38)40-25-30-15-4-5-16-32(30)27-42-40;46-36-23-9-8-21-34(36)39-43-37(29-14-2-1-3-15-29)42-38(44-39)30-17-10-18-31(26-30)45(35-22-11-16-27-12-4-6-19-32(27)35)40-33-20-7-5-13-28(33)24-25-41-40;;;;/h1-26,28,48H;1-25,27,46H;1-23,25-27,46H;1-25,46H;;;;/q4*-1
• InChIKey: ZVLXXIIOTZZVED-UHFFFAOYSA-N
• XLogP: 39.91
• TPSA: 274.34 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 22
• Rotatable Bonds: 25
• Heavy Atoms: 190
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3175.10
LogP ≤ 5	39.91
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	22

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum?

The IUPAC name of 2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum (CID 158213354) is 2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum.

What is the SMILES notation for 2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum?

The canonical SMILES for 2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum is Oc1ccccc1-c1cc(-c2ccccc2)nc(-c2[c-]c(N(c3cc4ccccc4cn3)c3cccc4ccccc34)ccc2)n1.Oc1ccccc1-c1nc(-c2[c-]c(N(c3cc(-c4ccccc4)ccn3)c3cccc4ccccc34)ccc2)nc(-c2ccccc2)n1.Oc1ccccc1-c1nc(-c2[c-]c(N(c3cccc4ccccc34)c3nccc4ccccc34)ccc2)cnc1-c1ccccc1.Oc1ccccc1-c1nc(-c2[c-]c(N(c3cccc4ccccc34)c3nccc4ccccc34)ccc2)nc(-c2ccccc2)n1.[Pt].[Pt].[Pt].[Pt].

What is the InChIKey of 2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum?

The InChIKey is ZVLXXIIOTZZVED-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H28N5O.2C41H27N4O.C40H26N5O.4Pt/c48-38-24-10-9-22-36(38)42-45-40(31-16-5-2-6-17-31)44-41(46-42)33-19-11-20-34(27-33)47(37-23-12-18-30-15-7-8-21-35(30)37)39-28-32(25-26-43-39)29-13-3-1-4-14-29;46-38-23-9-8-21-35(38)40-39(30-14-2-1-3-15-30)43-27-36(44-40)31-17-10-18-32(26-31)45(37-22-11-16-28-12-4-6-19-33(28)37)41-34-20-7-5-13-29(34)24-25-42-41;46-39-23-9-8-21-35(39)37-26-36(29-13-2-1-3-14-29)43-41(44-37)31-18-10-19-33(24-31)45(38-22-11-17-28-12-6-7-20-34(28)38)40-25-30-15-4-5-16-32(30)27-42-40;46-36-23-9-8-21-34(36)39-43-37(29-14-2-1-3-15-29)42-38(44-39)30-17-10-18-31(26-30)45(35-22-11-16-27-12-4-6-19-32(27)35)40-33-20-7-5-13-28(33)24-25-41-40;;;;/h1-26,28,48H;1-25,27,46H;1-23,25-27,46H;1-25,46H;;;;/q4*-1;;;;.

What are the key properties of 2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum?

2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum has a molecular weight of 3175.10 g/mol, XLogP of 39.91, 25 rotatable bonds, 4 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[6-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-3-phenylpyrazin-2-yl]phenol;2-[2-[3-[isoquinolin-3-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenylpyrimidin-4-yl]phenol;2-[4-[3-[isoquinolin-1-yl(naphthalen-1-yl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;2-[4-[3-[naphthalen-1-yl-(4-phenyl-2-pyridinyl)amino]benzene-2-id-1-yl]-6-phenyl-1,3,5-triazin-2-yl]phenol;platinum is sourced from PubChem (CID 158213354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).