bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)

C24H26N4O4Pt — CID 59661525

IUPACbis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)
SMILESCOc1c[c-]c(-c2nccn2C)c(OC)c1.COc1c[c-]c(-c2nccn2C)c(OC)c1.[Pt+2]
InChIInChI=1S/2C12H13N2O2.Pt/c2*1-14-7-6-13-12(14)10-5-4-9(15-2)8-11(10)16-3;/h2*4,6-8H,1-3H3;/q2*-1;+2
InChIKeyPICHEJSPRCLVFM-UHFFFAOYSA-N
MW629.57 g/mol
LogP3.81
Rot. Bonds6

About bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)

bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+) (PubChem CID 59661525) has the molecular formula C24H26N4O4Pt and a molecular weight of 629.57 g/mol. Its IUPAC name is bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+).

Molecular Properties

Compound Namebis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)
PubChem CID59661525
Molecular FormulaC24H26N4O4Pt
Molecular Weight629.57 g/mol
Exact Mass629.16
IUPAC Namebis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)
SMILESCOc1c[c-]c(-c2nccn2C)c(OC)c1.COc1c[c-]c(-c2nccn2C)c(OC)c1.[Pt+2]
InChIInChI=1S/2C12H13N2O2.Pt/c2*1-14-7-6-13-12(14)10-5-4-9(15-2)8-11(10)16-3;/h2*4,6-8H,1-3H3;/q2*-1;+2
InChIKeyPICHEJSPRCLVFM-UHFFFAOYSA-N
XLogP3.81
TPSA72.56 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500629.57
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

1-Methyl-2-(3-methylbenzene-6-id-1-yl)imidazole;1-methyl-2-phenylimidazole;platinum(2+)
CID 58163118
2-(2,4-Dimethoxybenzene-6-id-1-yl)-1-methylimidazole;[3-(hydroxymethyl)-4-(1-methylimidazol-2-yl)benzene-5-id-1-yl]methanol;iridium(3+);[5-methoxy-2-(1-methylimidazol-2-yl)benzene-3-id-1-yl]methanol
CID 58401274
2-(2,4-Dimethylbenzene-6-id-1-yl)-1-methylimidazole;2-(2,4-dimethylbenzene-6-id-1-yl)-1-methylimidazol-1-ium-3-ide;platinum
CID 58401313
2-(2,4-Dimethoxybenzene-6-id-1-yl)-1-methylimidazol-1-ium-3-ide;[5-methoxy-2-(1-methylimidazol-2-yl)benzene-3-id-1-yl]methanol;platinum
CID 58401401
Iridium(3+);2-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole;bis(1-methyl-2-phenylimidazole)
CID 58401633
2-(2-Methoxybenzene-6-id-1-yl)-1-methylimidazol-1-ium-3-ide;[2-(1-methylimidazol-2-yl)benzene-3-id-1-yl]methanol;platinum
CID 58401732
1-Methyl-2-phenylimidazole;1-methyl-2-phenylimidazol-1-ium-3-ide;platinum
CID 58401739
2-(2,4-Dimethoxybenzene-6-id-1-yl)-1-methylimidazole;iridium
CID 58769491
2-(3-Bromo-4-methoxybenzene-6-id-1-yl)-1-(1-methylimidazol-2-yl)imidazole;iridium
CID 58947203
Bis(2-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)
CID 59661441
2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazol-1-ium-3-ide;(Z)-4-hydroxy-3-methylpent-3-en-2-one;platinum(2+)
CID 59661451
Tris(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);iridium(3+)
CID 59661504

Frequently Asked Questions

What is the IUPAC name of bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)?
The IUPAC name of bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+) (CID 59661525) is bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+).
What is the SMILES notation for bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)?
The canonical SMILES for bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+) is COc1c[c-]c(-c2nccn2C)c(OC)c1.COc1c[c-]c(-c2nccn2C)c(OC)c1.[Pt+2].
What is the InChIKey of bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)?
The InChIKey is PICHEJSPRCLVFM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H13N2O2.Pt/c2*1-14-7-6-13-12(14)10-5-4-9(15-2)8-11(10)16-3;/h2*4,6-8H,1-3H3;/q2*-1;+2.
What are the key properties of bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)?
bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+) has a molecular weight of 629.57 g/mol, XLogP of 3.81, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+) is sourced from PubChem (CID 59661525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).