2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum

C34H26N3O2Pt- — CID 176605775

About 2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum

2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum (PubChem CID 176605775) has the molecular formula C34H26N3O2Pt- and a molecular weight of 703.68 g/mol. Its IUPAC name is 2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum.

Molecular Properties

• Compound Name: 2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum
• PubChem CID: 176605775
• Molecular Formula: C34H26N3O2Pt-
• Molecular Weight: 703.68 g/mol
• Exact Mass: 703.17
• IUPAC Name: 2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum
• SMILES: Cc1ccc2c(C(C)C)cc(Oc3[c-]c4c(cc3)c3ccccc3n4-c3nccc4ccccc34)nc2c1O.[Pt]
• InChI: InChI=1S/C34H26N3O2.Pt/c1-20(2)28-19-31(36-32-27(28)14-12-21(3)33(32)38)39-23-13-15-26-25-10-6-7-11-29(25)37(30(26)18-23)34-24-9-5-4-8-22(24)16-17-35-34;/h4-17,19-20,38H,1-3H3;/q-1
• InChIKey: DQNWUPNCNISTTG-UHFFFAOYSA-N
• XLogP: 8.61
• TPSA: 60.17 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 4
• Heavy Atoms: 40
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	703.68
LogP ≤ 5	8.61
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum?

The IUPAC name of 2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum (CID 176605775) is 2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum.

What is the SMILES notation for 2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum?

The canonical SMILES for 2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum is Cc1ccc2c(C(C)C)cc(Oc3[c-]c4c(cc3)c3ccccc3n4-c3nccc4ccccc34)nc2c1O.[Pt].

What is the InChIKey of 2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum?

The InChIKey is DQNWUPNCNISTTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H26N3O2.Pt/c1-20(2)28-19-31(36-32-27(28)14-12-21(3)33(32)38)39-23-13-15-26-25-10-6-7-11-29(25)37(30(26)18-23)34-24-9-5-4-8-22(24)16-17-35-34;/h4-17,19-20,38H,1-3H3;/q-1;.

What are the key properties of 2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum?

2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum has a molecular weight of 703.68 g/mol, XLogP of 8.61, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(9-isoquinolin-1-yl-1H-carbazol-1-id-2-yl)oxy]-7-methyl-4-propan-2-ylquinolin-8-ol;platinum is sourced from PubChem (CID 176605775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).