potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate

C13H15ClKNO3Pt — CID 57341344

IUPACpotassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate
SMILESCC(C)C[C@H](/N=C/c1ccccc1[O-])C(=O)[O-].Cl[Pt+].[K+]
InChIInChI=1S/C13H17NO3.ClH.K.Pt/c1-9(2)7-11(13(16)17)14-8-10-5-3-4-6-12(10)15;;;/h3-6,8-9,11,15H,7H2,1-2H3,(H,16,17);1H;;/q;;+1;+2/p-3/b14-8+;;;/t11-;;;/m0.../s1
InChIKeyWWTYJYYLANANKC-GCSZCBLPSA-K
MW502.90 g/mol
LogP-1.97
Rot. Bonds5

About potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate

potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate (PubChem CID 57341344) has the molecular formula C13H15ClKNO3Pt and a molecular weight of 502.90 g/mol. Its IUPAC name is potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate.

Molecular Properties

Compound Namepotassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate
PubChem CID57341344
Molecular FormulaC13H15ClKNO3Pt
Molecular Weight502.90 g/mol
Exact Mass502.00
IUPAC Namepotassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate
SMILESCC(C)C[C@H](/N=C/c1ccccc1[O-])C(=O)[O-].Cl[Pt+].[K+]
InChIInChI=1S/C13H17NO3.ClH.K.Pt/c1-9(2)7-11(13(16)17)14-8-10-5-3-4-6-12(10)15;;;/h3-6,8-9,11,15H,7H2,1-2H3,(H,16,17);1H;;/q;;+1;+2/p-3/b14-8+;;;/t11-;;;/m0.../s1
InChIKeyWWTYJYYLANANKC-GCSZCBLPSA-K
XLogP-1.97
TPSA75.55 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500502.90
LogP ≤ 5-1.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate?
The IUPAC name of potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate (CID 57341344) is potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate.
What is the SMILES notation for potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate?
The canonical SMILES for potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate is CC(C)C[C@H](/N=C/c1ccccc1[O-])C(=O)[O-].Cl[Pt+].[K+].
What is the InChIKey of potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate?
The InChIKey is WWTYJYYLANANKC-GCSZCBLPSA-K. The full InChI is InChI=1S/C13H17NO3.ClH.K.Pt/c1-9(2)7-11(13(16)17)14-8-10-5-3-4-6-12(10)15;;;/h3-6,8-9,11,15H,7H2,1-2H3,(H,16,17);1H;;/q;;+1;+2/p-3/b14-8+;;;/t11-;;;/m0.../s1.
What are the key properties of potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate?
potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate has a molecular weight of 502.90 g/mol, XLogP of -1.97, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;chloroplatinum(1+);(2S)-4-methyl-2-[(2-oxidophenyl)methylideneamino]pentanoate is sourced from PubChem (CID 57341344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).