2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)

C23H14N4Pt — CID 58518130

IUPAC2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
SMILES[Pt+2].[c-]1cccc2ccn3cc(Cc4cn5ccc6ccc[c-]c6c5n4)nc3c12
InChIInChI=1S/C23H14N4.Pt/c1-3-7-20-16(5-1)9-11-26-14-18(24-22(20)26)13-19-15-27-12-10-17-6-2-4-8-21(17)23(27)25-19;/h1-6,9-12,14-15H,13H2;/q-2;+2
InChIKeyPMRGQLNWSOGKCN-UHFFFAOYSA-N
MW541.47 g/mol
LogP4.48
Rot. Bonds2

About 2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)

2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+) (PubChem CID 58518130) has the molecular formula C23H14N4Pt and a molecular weight of 541.47 g/mol. Its IUPAC name is 2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+).

Molecular Properties

Compound Name2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
PubChem CID58518130
Molecular FormulaC23H14N4Pt
Molecular Weight541.47 g/mol
Exact Mass541.09
IUPAC Name2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
SMILES[Pt+2].[c-]1cccc2ccn3cc(Cc4cn5ccc6ccc[c-]c6c5n4)nc3c12
InChIInChI=1S/C23H14N4.Pt/c1-3-7-20-16(5-1)9-11-26-14-18(24-22(20)26)13-19-15-27-12-10-17-6-2-4-8-21(17)23(27)25-19;/h1-6,9-12,14-15H,13H2;/q-2;+2
InChIKeyPMRGQLNWSOGKCN-UHFFFAOYSA-N
XLogP4.48
TPSA34.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500541.47
LogP ≤ 54.48
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

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1-Methyl-4-[2-(1-methyl-2-phenylimidazol-4-yl)propan-2-yl]-2-phenylimidazole;platinum(2+)
CID 58162154
Dilithium;1-methyl-4-[2-(1-methyl-2-phenylimidazol-4-yl)propan-2-yl]-2-phenylimidazole
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Bis(1,2-dimethyl-4-(2-methylbenzene-6-id-1-yl)imidazole);platinum(2+)
CID 58401867
5-tert-butyl-2-[2-(5-tert-butyl-10H-imidazo[2,1-a]isoquinolin-10-id-2-yl)ethyl]-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
CID 58517469
2-[3-(10H-imidazo[2,1-a]isoquinolin-10-id-2-yl)propyl]-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
CID 58517648
5-tert-butyl-2-[(5-tert-butyl-10H-imidazo[2,1-a]isoquinolin-10-id-2-yl)methyl]-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
CID 58517772
2-[2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-yl)ethyl]-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
CID 58518096
CID 58943936
CID 58943936

Frequently Asked Questions

What is the IUPAC name of 2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)?
The IUPAC name of 2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+) (CID 58518130) is 2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+).
What is the SMILES notation for 2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)?
The canonical SMILES for 2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+) is [Pt+2].[c-]1cccc2ccn3cc(Cc4cn5ccc6ccc[c-]c6c5n4)nc3c12.
What is the InChIKey of 2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)?
The InChIKey is PMRGQLNWSOGKCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H14N4.Pt/c1-3-7-20-16(5-1)9-11-26-14-18(24-22(20)26)13-19-15-27-12-10-17-6-2-4-8-21(17)23(27)25-19;/h1-6,9-12,14-15H,13H2;/q-2;+2.
What are the key properties of 2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)?
2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+) has a molecular weight of 541.47 g/mol, XLogP of 4.48, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(10H-imidazo[2,1-a]isoquinolin-10-id-2-ylmethyl)-10H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+) is sourced from PubChem (CID 58518130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).