bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+)

C22H18N4Pt — CID 58401688

IUPACbis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+)
SMILES[Pt+2].[c-]1cccc2c1-c1nccn1CC2.[c-]1cccc2c1-c1nccn1CC2
InChIInChI=1S/2C11H9N2.Pt/c2*1-2-4-10-9(3-1)5-7-13-8-6-12-11(10)13;/h2*1-3,6,8H,5,7H2;/q2*-1;+2
InChIKeyQQIGJQVSJIRLRQ-UHFFFAOYSA-N
MW533.49 g/mol
LogP3.81
Rot. Bonds

About bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+)

bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+) (PubChem CID 58401688) has the molecular formula C22H18N4Pt and a molecular weight of 533.49 g/mol. Its IUPAC name is bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+).

Molecular Properties

Compound Namebis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+)
PubChem CID58401688
Molecular FormulaC22H18N4Pt
Molecular Weight533.49 g/mol
Exact Mass533.12
IUPAC Namebis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+)
SMILES[Pt+2].[c-]1cccc2c1-c1nccn1CC2.[c-]1cccc2c1-c1nccn1CC2
InChIInChI=1S/2C11H9N2.Pt/c2*1-2-4-10-9(3-1)5-7-13-8-6-12-11(10)13;/h2*1-3,6,8H,5,7H2;/q2*-1;+2
InChIKeyQQIGJQVSJIRLRQ-UHFFFAOYSA-N
XLogP3.81
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500533.49
LogP ≤ 53.81
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(2-(2-methylbenzene-6-id-1-yl)-1-(2,2,2-trifluoroethyl)imidazole);platinum(2+)
CID 59661470
CID 57759350
CID 57759350
1-Methyl-2-(3-methylbenzene-6-id-1-yl)imidazole;1-methyl-2-phenylimidazole;platinum(2+)
CID 58163118
1-Methyl-2-(2-methylbenzene-6-id-1-yl)imidazole;1-methyl-2-(2-methylbenzene-6-id-1-yl)imidazol-1-ium-3-ide;platinum
CID 58401371
tris(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);iridium(3+)
CID 58401512
Bis(2-(2-methylbenzene-6-id-1-yl)-1-propan-2-ylimidazole);platinum(2+)
CID 58401808
CID 58943899
CID 58943899
3a,4,5,9-tetrahydrobenzo[g]indol-9-ide;bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);iridium(3+)
CID 59661521
10H-imidazo[2,1-a]isoquinolin-10-ide;iridium;bis(1-methyl-3-phenyl-2H-imidazol-2-ide)
CID 140876493
3,5-bis(1-methylimidazol-2-yl)-4H-pyridin-4-ide;methylbenzene;platinum(2+)
CID 156661532

Frequently Asked Questions

What is the IUPAC name of bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+)?
The IUPAC name of bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+) (CID 58401688) is bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+).
What is the SMILES notation for bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+)?
The canonical SMILES for bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+) is [Pt+2].[c-]1cccc2c1-c1nccn1CC2.[c-]1cccc2c1-c1nccn1CC2.
What is the InChIKey of bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+)?
The InChIKey is QQIGJQVSJIRLRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H9N2.Pt/c2*1-2-4-10-9(3-1)5-7-13-8-6-12-11(10)13;/h2*1-3,6,8H,5,7H2;/q2*-1;+2.
What are the key properties of bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+)?
bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+) has a molecular weight of 533.49 g/mol, XLogP of 3.81, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide);platinum(2+) is sourced from PubChem (CID 58401688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).