benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+))

C44H30N4Pt2 — CID 21024828

IUPACbenzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+))
SMILES[Pt+2].[Pt+2].[c-]1c(-c2ccccn2)cc(-c2cc(-c3ccccn3)[c-]c(-c3ccccn3)c2)cc1-c1ccccn1.[c-]1ccccc1.[c-]1ccccc1
InChIInChI=1S/C32H20N4.2C6H5.2Pt/c1-5-13-33-29(9-1)25-17-23(18-26(21-25)30-10-2-6-14-34-30)24-19-27(31-11-3-7-15-35-31)22-28(20-24)32-12-4-8-16-36-32;2*1-2-4-6-5-3-1;;/h1-20H;2*1-5H;;/q-2;2*-1;2*+2
InChIKeyZAAZIOADEKFSGK-UHFFFAOYSA-N
MW1004.91 g/mol
LogP10.17
Rot. Bonds5

About benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+))

benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+)) (PubChem CID 21024828) has the molecular formula C44H30N4Pt2 and a molecular weight of 1004.91 g/mol. Its IUPAC name is benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+)).

Molecular Properties

Compound Namebenzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+))
PubChem CID21024828
Molecular FormulaC44H30N4Pt2
Molecular Weight1004.91 g/mol
Exact Mass1004.18
IUPAC Namebenzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+))
SMILES[Pt+2].[Pt+2].[c-]1c(-c2ccccn2)cc(-c2cc(-c3ccccn3)[c-]c(-c3ccccn3)c2)cc1-c1ccccn1.[c-]1ccccc1.[c-]1ccccc1
InChIInChI=1S/C32H20N4.2C6H5.2Pt/c1-5-13-33-29(9-1)25-17-23(18-26(21-25)30-10-2-6-14-34-30)24-19-27(31-11-3-7-15-35-31)22-28(20-24)32-12-4-8-16-36-32;2*1-2-4-6-5-3-1;;/h1-20H;2*1-5H;;/q-2;2*-1;2*+2
InChIKeyZAAZIOADEKFSGK-UHFFFAOYSA-N
XLogP10.17
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001004.91
LogP ≤ 510.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+)) with MolForge

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Related Compounds

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Ni(ii) meso-tetra (4-pyridyl) porphine
CID 4129663
Iridium;tris(2-phenylpyridine)
CID 23386734
(2-(4-methyl-5-phenyl-2-pyridinyl-kappaN)phenyl-kappaC)bis(2-(2-pyridinyl-kappaN)phenyl-kappaC) Iridium
CID 59546880
tris(2,2'-bipyridine)iron(II)
CID 6857601

Frequently Asked Questions

What is the IUPAC name of benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+))?
The IUPAC name of benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+)) (CID 21024828) is benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+)).
What is the SMILES notation for benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+))?
The canonical SMILES for benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+)) is [Pt+2].[Pt+2].[c-]1c(-c2ccccn2)cc(-c2cc(-c3ccccn3)[c-]c(-c3ccccn3)c2)cc1-c1ccccn1.[c-]1ccccc1.[c-]1ccccc1.
What is the InChIKey of benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+))?
The InChIKey is ZAAZIOADEKFSGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H20N4.2C6H5.2Pt/c1-5-13-33-29(9-1)25-17-23(18-26(21-25)30-10-2-6-14-34-30)24-19-27(31-11-3-7-15-35-31)22-28(20-24)32-12-4-8-16-36-32;2*1-2-4-6-5-3-1;;/h1-20H;2*1-5H;;/q-2;2*-1;2*+2.
What are the key properties of benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+))?
benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+)) has a molecular weight of 1004.91 g/mol, XLogP of 10.17, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;2-[3-(3,5-dipyridin-2-ylbenzene-4-id-1-yl)-5-pyridin-2-ylbenzene-6-id-1-yl]pyridine;bis(platinum(2+)) is sourced from PubChem (CID 21024828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).