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

C26H24N4OPt — CID 162492142

IUPAC9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
SMILESCc1cn2c(n1)-c1[c-]c(Oc3[c-]c4c(c(C)c3)CCn3cc(C)nc3-4)cc(C)c1CC2.[Pt+2]
InChIInChI=1S/C26H24N4O.Pt/c1-15-9-19(11-23-21(15)5-7-29-13-17(3)27-25(23)29)31-20-10-16(2)22-6-8-30-14-18(4)28-26(30)24(22)12-20;/h9-10,13-14H,5-8H2,1-4H3;/q-2;+2
InChIKeyPAZONQHICLRJCU-UHFFFAOYSA-N
MW603.58 g/mol
LogP5.15
Rot. Bonds2

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

9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+) (PubChem CID 162492142) has the molecular formula C26H24N4OPt and a molecular weight of 603.58 g/mol. Its IUPAC name is 9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+).

Molecular Properties

Compound Name9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
PubChem CID162492142
Molecular FormulaC26H24N4OPt
Molecular Weight603.58 g/mol
Exact Mass603.16
IUPAC Name9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)
SMILESCc1cn2c(n1)-c1[c-]c(Oc3[c-]c4c(c(C)c3)CCn3cc(C)nc3-4)cc(C)c1CC2.[Pt+2]
InChIInChI=1S/C26H24N4O.Pt/c1-15-9-19(11-23-21(15)5-7-29-13-17(3)27-25(23)29)31-20-10-16(2)22-6-8-30-14-18(4)28-26(30)24(22)12-20;/h9-10,13-14H,5-8H2,1-4H3;/q-2;+2
InChIKeyPAZONQHICLRJCU-UHFFFAOYSA-N
XLogP5.15
TPSA44.87 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms32
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500603.58
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)?
The IUPAC name of 9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+) (CID 162492142) is 9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+).
What is the SMILES notation for 9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)?
The canonical SMILES for 9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+) is Cc1cn2c(n1)-c1[c-]c(Oc3[c-]c4c(c(C)c3)CCn3cc(C)nc3-4)cc(C)c1CC2.[Pt+2].
What is the InChIKey of 9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)?
The InChIKey is PAZONQHICLRJCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N4O.Pt/c1-15-9-19(11-23-21(15)5-7-29-13-17(3)27-25(23)29)31-20-10-16(2)22-6-8-30-14-18(4)28-26(30)24(22)12-20;/h9-10,13-14H,5-8H2,1-4H3;/q-2;+2.
What are the key properties of 9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+)?
9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+) has a molecular weight of 603.58 g/mol, XLogP of 5.15, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-id-9-yl)oxy]-2,7-dimethyl-6,10-dihydro-5H-imidazo[2,1-a]isoquinolin-10-ide;platinum(2+) is sourced from PubChem (CID 162492142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).