bis(1,5-dimethyl-4-phenylimidazole);platinum(2+)

C22H22N4Pt — CID 58401905

IUPACbis(1,5-dimethyl-4-phenylimidazole);platinum(2+)
SMILESCc1c(-c2[c-]cccc2)ncn1C.Cc1c(-c2[c-]cccc2)ncn1C.[Pt+2]
InChIInChI=1S/2C11H11N2.Pt/c2*1-9-11(12-8-13(9)2)10-6-4-3-5-7-10;/h2*3-6,8H,1-2H3;/q2*-1;+2
InChIKeySIYQPVFFXYRASS-UHFFFAOYSA-N
MW537.52 g/mol
LogP4.39
Rot. Bonds2

About bis(1,5-dimethyl-4-phenylimidazole);platinum(2+)

bis(1,5-dimethyl-4-phenylimidazole);platinum(2+) (PubChem CID 58401905) has the molecular formula C22H22N4Pt and a molecular weight of 537.52 g/mol. Its IUPAC name is bis(1,5-dimethyl-4-phenylimidazole);platinum(2+).

Molecular Properties

Compound Namebis(1,5-dimethyl-4-phenylimidazole);platinum(2+)
PubChem CID58401905
Molecular FormulaC22H22N4Pt
Molecular Weight537.52 g/mol
Exact Mass537.15
IUPAC Namebis(1,5-dimethyl-4-phenylimidazole);platinum(2+)
SMILESCc1c(-c2[c-]cccc2)ncn1C.Cc1c(-c2[c-]cccc2)ncn1C.[Pt+2]
InChIInChI=1S/2C11H11N2.Pt/c2*1-9-11(12-8-13(9)2)10-6-4-3-5-7-10;/h2*3-6,8H,1-2H3;/q2*-1;+2
InChIKeySIYQPVFFXYRASS-UHFFFAOYSA-N
XLogP4.39
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500537.52
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Bis(5-methyl-4-(2-methylbenzene-6-id-1-yl)-1-(2,2,2-trifluoroethyl)imidazole);platinum(2+)
CID 59661443
1,5-Dimethyl-4-phenylimidazole;iridium
CID 57596136
Bis(2-tert-butyl-1-methyl-4-phenylimidazole);difluoroiridium(1+);iridium
CID 58163247
Tris(4-(2,4-dimethylbenzene-6-id-1-yl)-1-methylimidazole);iridium(3+)
CID 58401349
1,5-Dimethyl-4-phenylimidazole;3,5-dimethyl-1-phenyl-1,2,4-triazole;platinum(2+)
CID 58401365
Iridium(3+);tris(1,2,5-trimethyl-4-phenylimidazole)
CID 58401390
Bis(1,5-dimethyl-4-(2-methylbenzene-6-id-1-yl)imidazole);platinum(2+)
CID 58401570
Tris(1,5-dimethyl-4-(2-methylbenzene-6-id-1-yl)imidazole);iridium(3+)
CID 58401703
Bis(4-(2,4-dimethylbenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)
CID 58401799
bis(3-(1,5-dimethylimidazol-4-yl)-4H-pyridin-4-ide);platinum(2+)
CID 58401802
Tris(1,5-dimethyl-4-phenylimidazole);iridium(3+)
CID 58401830
bis(3-methyl-5,9-dihydro-4H-benzo[e]benzimidazol-9-ide);platinum(2+)
CID 58401857

Frequently Asked Questions

What is the IUPAC name of bis(1,5-dimethyl-4-phenylimidazole);platinum(2+)?
The IUPAC name of bis(1,5-dimethyl-4-phenylimidazole);platinum(2+) (CID 58401905) is bis(1,5-dimethyl-4-phenylimidazole);platinum(2+).
What is the SMILES notation for bis(1,5-dimethyl-4-phenylimidazole);platinum(2+)?
The canonical SMILES for bis(1,5-dimethyl-4-phenylimidazole);platinum(2+) is Cc1c(-c2[c-]cccc2)ncn1C.Cc1c(-c2[c-]cccc2)ncn1C.[Pt+2].
What is the InChIKey of bis(1,5-dimethyl-4-phenylimidazole);platinum(2+)?
The InChIKey is SIYQPVFFXYRASS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H11N2.Pt/c2*1-9-11(12-8-13(9)2)10-6-4-3-5-7-10;/h2*3-6,8H,1-2H3;/q2*-1;+2.
What are the key properties of bis(1,5-dimethyl-4-phenylimidazole);platinum(2+)?
bis(1,5-dimethyl-4-phenylimidazole);platinum(2+) has a molecular weight of 537.52 g/mol, XLogP of 4.39, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1,5-dimethyl-4-phenylimidazole);platinum(2+) is sourced from PubChem (CID 58401905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).