platinum;2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)pyrido[2,3-b]indol-2-yl]phenol

C34H21N4OPt- — CID 164823577

About platinum;2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)pyrido[2,3-b]indol-2-yl]phenol

platinum;2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)pyrido[2,3-b]indol-2-yl]phenol (PubChem CID 164823577) has the molecular formula C34H21N4OPt- and a molecular weight of 696.65 g/mol. Its IUPAC name is platinum;2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)pyrido[2,3-b]indol-2-yl]phenol.

Molecular Properties

• Compound Name: platinum;2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)pyrido[2,3-b]indol-2-yl]phenol
• PubChem CID: 164823577
• Molecular Formula: C34H21N4OPt-
• Molecular Weight: 696.65 g/mol
• Exact Mass: 696.14
• IUPAC Name: platinum;2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)pyrido[2,3-b]indol-2-yl]phenol
• SMILES: Oc1ccccc1-c1ccc2c3ccccc3n(-c3[c-]c(-n4c5ccccc5c5cccnc54)ccc3)c2n1.[Pt]
• InChI: InChI=1S/C34H21N4O.Pt/c39-32-17-6-3-13-28(32)29-19-18-27-25-12-2-5-16-31(25)38(34(27)36-29)23-10-7-9-22(21-23)37-30-15-4-1-11-24(30)26-14-8-20-35-33(26)37;/h1-20,39H;/q-1
• InChIKey: NXQAZBKTINTTLY-UHFFFAOYSA-N
• XLogP: 7.84
• TPSA: 55.87 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 40
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	696.65
LogP ≤ 5	7.84
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-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)pyrido[2,3-b]indol-2-yl]phenol?

The IUPAC name of platinum;2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)pyrido[2,3-b]indol-2-yl]phenol (CID 164823577) is platinum;2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)pyrido[2,3-b]indol-2-yl]phenol.

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

The canonical SMILES for platinum;2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)pyrido[2,3-b]indol-2-yl]phenol is Oc1ccccc1-c1ccc2c3ccccc3n(-c3[c-]c(-n4c5ccccc5c5cccnc54)ccc3)c2n1.[Pt].

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

The InChIKey is NXQAZBKTINTTLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H21N4O.Pt/c39-32-17-6-3-13-28(32)29-19-18-27-25-12-2-5-16-31(25)38(34(27)36-29)23-10-7-9-22(21-23)37-30-15-4-1-11-24(30)26-14-8-20-35-33(26)37;/h1-20,39H;/q-1;.

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

platinum;2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)pyrido[2,3-b]indol-2-yl]phenol has a molecular weight of 696.65 g/mol, XLogP of 7.84, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for platinum;2-[9-(3-pyrido[2,3-b]indol-9-ylbenzene-2-id-1-yl)pyrido[2,3-b]indol-2-yl]phenol is sourced from PubChem (CID 164823577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).