platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol

C31H24N3O2Pt- — CID 154590090

About platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol

platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol (PubChem CID 154590090) has the molecular formula C31H24N3O2Pt- and a molecular weight of 665.63 g/mol. Its IUPAC name is platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol.

Molecular Properties

• Compound Name: platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol
• PubChem CID: 154590090
• Molecular Formula: C31H24N3O2Pt-
• Molecular Weight: 665.63 g/mol
• Exact Mass: 665.15
• IUPAC Name: platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol
• SMILES: CC(C)c1ccnc(Oc2[c-]c(-c3ccc4c5ccccc5n(-c5ccccc5O)c4n3)ccc2)c1.[Pt]
• InChI: InChI=1S/C31H24N3O2.Pt/c1-20(2)21-16-17-32-30(19-21)36-23-9-7-8-22(18-23)26-15-14-25-24-10-3-4-11-27(24)34(31(25)33-26)28-12-5-6-13-29(28)35;/h3-17,19-20,35H,1-2H3;/q-1
• InChIKey: HFVKUAUXAJRGFK-UHFFFAOYSA-N
• XLogP: 7.66
• TPSA: 60.17 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 5
• Heavy Atoms: 37
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	665.63
LogP ≤ 5	7.66
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 platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol?

The IUPAC name of platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol (CID 154590090) is platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol.

What is the SMILES notation for platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol?

The canonical SMILES for platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol is CC(C)c1ccnc(Oc2[c-]c(-c3ccc4c5ccccc5n(-c5ccccc5O)c4n3)ccc2)c1.[Pt].

What is the InChIKey of platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol?

The InChIKey is HFVKUAUXAJRGFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H24N3O2.Pt/c1-20(2)21-16-17-32-30(19-21)36-23-9-7-8-22(18-23)26-15-14-25-24-10-3-4-11-27(24)34(31(25)33-26)28-12-5-6-13-29(28)35;/h3-17,19-20,35H,1-2H3;/q-1;.

What are the key properties of platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol?

platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol has a molecular weight of 665.63 g/mol, XLogP of 7.66, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for platinum;2-[2-[3-[(4-propan-2-yl-2-pyridinyl)oxy]benzene-2-id-1-yl]pyrido[2,3-b]indol-9-yl]phenol is sourced from PubChem (CID 154590090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).