potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate

C10H9ClKNO4Pt — CID 57341342

IUPACpotassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate
SMILESCl[Pt+].O=C([O-])[C@H](CO)/N=C/c1ccccc1[O-].[K+]
InChIInChI=1S/C10H11NO4.ClH.K.Pt/c12-6-8(10(14)15)11-5-7-3-1-2-4-9(7)13;;;/h1-5,8,12-13H,6H2,(H,14,15);1H;;/q;;+1;+2/p-3/b11-5+;;;/t8-;;;/m0.../s1
InChIKeyCDBVRRTXUIVWAH-QMGWQCRISA-K
MW476.81 g/mol
LogP-4.02
Rot. Bonds4

About potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate

potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate (PubChem CID 57341342) has the molecular formula C10H9ClKNO4Pt and a molecular weight of 476.81 g/mol. Its IUPAC name is potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate.

Molecular Properties

Compound Namepotassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate
PubChem CID57341342
Molecular FormulaC10H9ClKNO4Pt
Molecular Weight476.81 g/mol
Exact Mass475.95
IUPAC Namepotassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate
SMILESCl[Pt+].O=C([O-])[C@H](CO)/N=C/c1ccccc1[O-].[K+]
InChIInChI=1S/C10H11NO4.ClH.K.Pt/c12-6-8(10(14)15)11-5-7-3-1-2-4-9(7)13;;;/h1-5,8,12-13H,6H2,(H,14,15);1H;;/q;;+1;+2/p-3/b11-5+;;;/t8-;;;/m0.../s1
InChIKeyCDBVRRTXUIVWAH-QMGWQCRISA-K
XLogP-4.02
TPSA95.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500476.81
LogP ≤ 5-4.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate?
The IUPAC name of potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate (CID 57341342) is potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate.
What is the SMILES notation for potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate?
The canonical SMILES for potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate is Cl[Pt+].O=C([O-])[C@H](CO)/N=C/c1ccccc1[O-].[K+].
What is the InChIKey of potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate?
The InChIKey is CDBVRRTXUIVWAH-QMGWQCRISA-K. The full InChI is InChI=1S/C10H11NO4.ClH.K.Pt/c12-6-8(10(14)15)11-5-7-3-1-2-4-9(7)13;;;/h1-5,8,12-13H,6H2,(H,14,15);1H;;/q;;+1;+2/p-3/b11-5+;;;/t8-;;;/m0.../s1.
What are the key properties of potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate?
potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate has a molecular weight of 476.81 g/mol, XLogP of -4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;chloroplatinum(1+);(2S)-3-hydroxy-2-[(2-oxidophenyl)methylideneamino]propanoate is sourced from PubChem (CID 57341342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).