dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine

C116H106Cl2F3N25O4Os2P2Pt3 — CID 159089256

IUPACdichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
SMILESCC1(C)C2CCC1c1c2n[n-]c1-c1nccc2ccccc12.C[PH+](c1ccccc1)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cl[Pt]Cl.FC(F)(F)c1cc(-c2ccccn2)[n-]n1.O=C(O)c1ccccn1.[CH-]=O.[CH-]=O.[Os+2].[Os+4].[Pt+2].[Pt]
InChIInChI=1S/C19H18N3.2C13H13P.C9H5F3N3.6C9H8N3.C6H5NO2.2CHO.2ClH.2Os.3Pt/c1-19(2)13-7-8-14(19)17-15(13)18(22-21-17)16-12-6-4-3-5-11(12)9-10-20-16;2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;6*1-7-6-9(12-11-7)8-4-2-3-5-10-8;8-6(9)5-3-1-2-4-7-5;2*1-2;;;;;;;/h3-6,9-10,13-14H,7-8H2,1-2H3;2*2-11H,1H3;1-5H;6*2-6H,1H3;1-4H,(H,8,9);2*1H;2*1H;;;;;/q-1;;;7*-1;;2*-1;;;+2;+4;;2*+2
InChIKeyDUCVIQFQOAEPRK-UHFFFAOYSA-N
MW3069.84 g/mol
LogP21.39
Rot. Bonds13

About dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine

dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine (PubChem CID 159089256) has the molecular formula C116H106Cl2F3N25O4Os2P2Pt3 and a molecular weight of 3069.84 g/mol. Its IUPAC name is dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine.

Molecular Properties

Compound Namedichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
PubChem CID159089256
Molecular FormulaC116H106Cl2F3N25O4Os2P2Pt3
Molecular Weight3069.84 g/mol
Exact Mass3070.58
IUPAC Namedichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
SMILESCC1(C)C2CCC1c1c2n[n-]c1-c1nccc2ccccc12.C[PH+](c1ccccc1)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cl[Pt]Cl.FC(F)(F)c1cc(-c2ccccn2)[n-]n1.O=C(O)c1ccccn1.[CH-]=O.[CH-]=O.[Os+2].[Os+4].[Pt+2].[Pt]
InChIInChI=1S/C19H18N3.2C13H13P.C9H5F3N3.6C9H8N3.C6H5NO2.2CHO.2ClH.2Os.3Pt/c1-19(2)13-7-8-14(19)17-15(13)18(22-21-17)16-12-6-4-3-5-11(12)9-10-20-16;2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;6*1-7-6-9(12-11-7)8-4-2-3-5-10-8;8-6(9)5-3-1-2-4-7-5;2*1-2;;;;;;;/h3-6,9-10,13-14H,7-8H2,1-2H3;2*2-11H,1H3;1-5H;6*2-6H,1H3;1-4H,(H,8,9);2*1H;2*1H;;;;;/q-1;;;7*-1;;2*-1;;;+2;+4;;2*+2
InChIKeyDUCVIQFQOAEPRK-UHFFFAOYSA-N
XLogP21.39
TPSA403.37 Ų
H-Bond Donors1
H-Bond Acceptors20
Rotatable Bonds13
Heavy Atoms157
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003069.84
LogP ≤ 521.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine with MolForge

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

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine?
The IUPAC name of dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine (CID 159089256) is dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine.
What is the SMILES notation for dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine?
The canonical SMILES for dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine is CC1(C)C2CCC1c1c2n[n-]c1-c1nccc2ccccc12.C[PH+](c1ccccc1)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cc1cc(-c2ccccn2)[n-]n1.Cl[Pt]Cl.FC(F)(F)c1cc(-c2ccccn2)[n-]n1.O=C(O)c1ccccn1.[CH-]=O.[CH-]=O.[Os+2].[Os+4].[Pt+2].[Pt].
What is the InChIKey of dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine?
The InChIKey is DUCVIQFQOAEPRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N3.2C13H13P.C9H5F3N3.6C9H8N3.C6H5NO2.2CHO.2ClH.2Os.3Pt/c1-19(2)13-7-8-14(19)17-15(13)18(22-21-17)16-12-6-4-3-5-11(12)9-10-20-16;2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;10-9(11,12)8-5-7(14-15-8)6-3-1-2-4-13-6;6*1-7-6-9(12-11-7)8-4-2-3-5-10-8;8-6(9)5-3-1-2-4-7-5;2*1-2;;;;;;;/h3-6,9-10,13-14H,7-8H2,1-2H3;2*2-11H,1H3;1-5H;6*2-6H,1H3;1-4H,(H,8,9);2*1H;2*1H;;;;;/q-1;;;7*-1;;2*-1;;;+2;+4;;2*+2.
What are the key properties of dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine?
dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine has a molecular weight of 3069.84 g/mol, XLogP of 21.39, 13 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for dichloroplatinum;5-isoquinolin-1-yl-10,10-dimethyl-3-aza-4-azanidatricyclo[5.2.1.02,6]deca-2,5-diene;methanone;bis(methyl(diphenyl)phosphanium);hexakis(2-(5-methylpyrazol-2-id-3-yl)pyridine);osmium(2+);osmium(4+);platinum;platinum(2+);pyridine-2-carboxylic acid;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine is sourced from PubChem (CID 159089256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).