7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+)

C23H18N4O2Pt — CID 162492136

IUPAC7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+)
SMILESCc1cc(Oc2[c-]c3c(c(C)c2)OCn2ccnc2-3)[c-]c2c1CCn1ccnc1-2.[Pt+2]
InChIInChI=1S/C23H18N4O2.Pt/c1-14-9-16(11-19-18(14)3-6-26-7-4-24-22(19)26)29-17-10-15(2)21-20(12-17)23-25-5-8-27(23)13-28-21;/h4-5,7-10H,3,6,13H2,1-2H3;/q-2;+2
InChIKeyMEFUXHFXOGTLJR-UHFFFAOYSA-N
MW577.50 g/mol
LogP4.33
Rot. Bonds2

About 7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+)

7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+) (PubChem CID 162492136) has the molecular formula C23H18N4O2Pt and a molecular weight of 577.50 g/mol. Its IUPAC name is 7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+).

Molecular Properties

Compound Name7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+)
PubChem CID162492136
Molecular FormulaC23H18N4O2Pt
Molecular Weight577.50 g/mol
Exact Mass577.11
IUPAC Name7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+)
SMILESCc1cc(Oc2[c-]c3c(c(C)c2)OCn2ccnc2-3)[c-]c2c1CCn1ccnc1-2.[Pt+2]
InChIInChI=1S/C23H18N4O2.Pt/c1-14-9-16(11-19-18(14)3-6-26-7-4-24-22(19)26)29-17-10-15(2)21-20(12-17)23-25-5-8-27(23)13-28-21;/h4-5,7-10H,3,6,13H2,1-2H3;/q-2;+2
InChIKeyMEFUXHFXOGTLJR-UHFFFAOYSA-N
XLogP4.33
TPSA54.10 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500577.50
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

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
Bis(2-(2-methoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)
CID 59661441
Tris(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);iridium(3+)
CID 59661504
Bis(2-(2,4-dimethoxybenzene-6-id-1-yl)-1-methylimidazole);platinum(2+)
CID 59661525
Bis(2-(2,4-dimethylbenzene-6-id-1-yl)-1-methylimidazole);iridium(3+);2-(2-methoxy-4-methylbenzene-6-id-1-yl)-1-methylimidazole
CID 59661608
2-(2,4-Dimethoxybenzene-6-id-1-yl)-1-methylimidazole;3-methoxy-4-(1-methylimidazol-2-yl)benzene-5-ide-1-carbaldehyde;platinum(2+)
CID 59661654
1-Methyl-2-[3-[3-(1-methylimidazol-2-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]imidazole;palladium(2+)
CID 162451604
platinum(2+);2,5,5-trimethyl-9-[(2-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-6,10-dihydroimidazo[2,1-a]isoquinolin-10-ide
CID 162492039
7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
CID 162492043
3-isocyano-9-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]oxy-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum
CID 162492048
9-(6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yloxy)-6,10-dihydro-5H-imidazo[1,2-c]quinazolin-10-ide;platinum(2+)
CID 162492053

Frequently Asked Questions

What is the IUPAC name of 7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+)?
The IUPAC name of 7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+) (CID 162492136) is 7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+).
What is the SMILES notation for 7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+)?
The canonical SMILES for 7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+) is Cc1cc(Oc2[c-]c3c(c(C)c2)OCn2ccnc2-3)[c-]c2c1CCn1ccnc1-2.[Pt+2].
What is the InChIKey of 7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+)?
The InChIKey is MEFUXHFXOGTLJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N4O2.Pt/c1-14-9-16(11-19-18(14)3-6-26-7-4-24-22(19)26)29-17-10-15(2)21-20(12-17)23-25-5-8-27(23)13-28-21;/h4-5,7-10H,3,6,13H2,1-2H3;/q-2;+2.
What are the key properties of 7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+)?
7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+) has a molecular weight of 577.50 g/mol, XLogP of 4.33, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-9-[(7-methyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-5,10-dihydroimidazo[1,2-c][1,3]benzoxazin-10-ide;platinum(2+) is sourced from PubChem (CID 162492136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).