chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole

C15H15ClN4Pt- — CID 58130237

IUPACchloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole
SMILESCc1cc(C)n(-c2[c-]c(-n3[c-][n+](C)cc3)ccc2)n1.Cl[Pt]
InChIInChI=1S/C15H15N4.ClH.Pt/c1-12-9-13(2)19(16-12)15-6-4-5-14(10-15)18-8-7-17(3)11-18;;/h4-9H,1-3H3;1H;/q-1;;+1/p-1
InChIKeyFRNVFPNJLIYPTC-UHFFFAOYSA-M
MW481.84 g/mol
LogP2.39
Rot. Bonds2

About chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole

chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole (PubChem CID 58130237) has the molecular formula C15H15ClN4Pt- and a molecular weight of 481.84 g/mol. Its IUPAC name is chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole.

Molecular Properties

Compound Namechloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole
PubChem CID58130237
Molecular FormulaC15H15ClN4Pt-
Molecular Weight481.84 g/mol
Exact Mass481.06
IUPAC Namechloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole
SMILESCc1cc(C)n(-c2[c-]c(-n3[c-][n+](C)cc3)ccc2)n1.Cl[Pt]
InChIInChI=1S/C15H15N4.ClH.Pt/c1-12-9-13(2)19(16-12)15-6-4-5-14(10-15)18-8-7-17(3)11-18;;/h4-9H,1-3H3;1H;/q-1;;+1/p-1
InChIKeyFRNVFPNJLIYPTC-UHFFFAOYSA-M
XLogP2.39
TPSA26.63 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500481.84
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole 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 chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole?
The IUPAC name of chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole (CID 58130237) is chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole.
What is the SMILES notation for chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole?
The canonical SMILES for chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole is Cc1cc(C)n(-c2[c-]c(-n3[c-][n+](C)cc3)ccc2)n1.Cl[Pt].
What is the InChIKey of chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole?
The InChIKey is FRNVFPNJLIYPTC-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H15N4.ClH.Pt/c1-12-9-13(2)19(16-12)15-6-4-5-14(10-15)18-8-7-17(3)11-18;;/h4-9H,1-3H3;1H;/q-1;;+1/p-1.
What are the key properties of chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole?
chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole has a molecular weight of 481.84 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for chloroplatinum;3,5-dimethyl-1-[3-(3-methyl-2H-imidazol-3-ium-2-id-1-yl)benzene-2-id-1-yl]pyrazole is sourced from PubChem (CID 58130237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).