carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate

C21H25N2O3Pt2- — CID 59891554

IUPACcarbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate
SMILESO.Oc1cccc2cccnc12.Oc1cccc2cccnc12.[195Pt+2].[195Pt].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/2C9H7NO.3CH3.H2O.2Pt/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;;;;;;/h2*1-6,11H;3*1H3;1H2;;/q;;3*-1;;;+2/i;;;;;;2*1+0
InChIKeyXCCWRVIFJXYWKD-GTBBATSHSA-N
MW743.37 g/mol
LogP4.40
Rot. Bonds

About carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate

carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate (PubChem CID 59891554) has the molecular formula C21H25N2O3Pt2- and a molecular weight of 743.37 g/mol. Its IUPAC name is carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate.

Molecular Properties

Compound Namecarbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate
PubChem CID59891554
Molecular FormulaC21H25N2O3Pt2-
Molecular Weight743.37 g/mol
Exact Mass743.12
IUPAC Namecarbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate
SMILESO.Oc1cccc2cccnc12.Oc1cccc2cccnc12.[195Pt+2].[195Pt].[CH3-].[CH3-].[CH3-]
InChIInChI=1S/2C9H7NO.3CH3.H2O.2Pt/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;;;;;;/h2*1-6,11H;3*1H3;1H2;;/q;;3*-1;;;+2/i;;;;;;2*1+0
InChIKeyXCCWRVIFJXYWKD-GTBBATSHSA-N
XLogP4.40
TPSA97.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500743.37
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

CID 54604144
CID 54604144
quinolin-8-ol;yttrium
CID 174635627
zinc quinolin-8-ol
CID 22057723
CID 87330016
CID 87330016
CID 6381061
CID 6381061
methanol;quinolin-8-ol
CID 161490698
CID 174914731
CID 174914731
oxozinc;quinolin-8-ol
CID 174943156
CID 70016201
CID 70016201
dimethyltin;bis(quinolin-8-ol)
CID 50910182
cobalt;methanediamine;bis(quinolin-8-ol)
CID 87691611
2-pyridin-2-ylpyridine;quinolin-8-ol
CID 67892593

Frequently Asked Questions

What is the IUPAC name of carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate?
The IUPAC name of carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate (CID 59891554) is carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate.
What is the SMILES notation for carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate?
The canonical SMILES for carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate is O.Oc1cccc2cccnc12.Oc1cccc2cccnc12.[195Pt+2].[195Pt].[CH3-].[CH3-].[CH3-].
What is the InChIKey of carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate?
The InChIKey is XCCWRVIFJXYWKD-GTBBATSHSA-N. The full InChI is InChI=1S/2C9H7NO.3CH3.H2O.2Pt/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;;;;;;/h2*1-6,11H;3*1H3;1H2;;/q;;3*-1;;;+2/i;;;;;;2*1+0.
What are the key properties of carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate?
carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate has a molecular weight of 743.37 g/mol, XLogP of 4.40, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;platinum-195;platinum-195(2+);bis(quinolin-8-ol);hydrate is sourced from PubChem (CID 59891554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).