bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))

C42H30N6Pt2S2 — CID 176621917

IUPACbis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))
SMILESCc1ccc2c(n1)[n-]c1ccccc12.Cc1ccc2c(n1)[n-]c1ccccc12.[Pt+2].[Pt+2].[c-]1ccccc1-c1nccs1.[c-]1ccccc1-c1nccs1
InChIInChI=1S/2C12H9N2.2C9H6NS.2Pt/c2*1-8-6-7-10-9-4-2-3-5-11(9)14-12(10)13-8;2*1-2-4-8(5-3-1)9-10-6-7-11-9;;/h2*2-7H,1H3;2*1-4,6-7H;;/q4*-1;2*+2
InChIKeyHYDCBRCTAFBMFB-UHFFFAOYSA-N
MW1073.03 g/mol
LogP10.52
Rot. Bonds2

About bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))

bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+)) (PubChem CID 176621917) has the molecular formula C42H30N6Pt2S2 and a molecular weight of 1073.03 g/mol. Its IUPAC name is bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+)).

Molecular Properties

Compound Namebis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))
PubChem CID176621917
Molecular FormulaC42H30N6Pt2S2
Molecular Weight1073.03 g/mol
Exact Mass1072.13
IUPAC Namebis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))
SMILESCc1ccc2c(n1)[n-]c1ccccc12.Cc1ccc2c(n1)[n-]c1ccccc12.[Pt+2].[Pt+2].[c-]1ccccc1-c1nccs1.[c-]1ccccc1-c1nccs1
InChIInChI=1S/2C12H9N2.2C9H6NS.2Pt/c2*1-8-6-7-10-9-4-2-3-5-11(9)14-12(10)13-8;2*1-2-4-8(5-3-1)9-10-6-7-11-9;;/h2*2-7H,1H3;2*1-4,6-7H;;/q4*-1;2*+2
InChIKeyHYDCBRCTAFBMFB-UHFFFAOYSA-N
XLogP10.52
TPSA79.76 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms52
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001073.03
LogP ≤ 510.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

3-[2-(1-methyl-1H-indol-3-yl)-1,3-thiazol-4-yl]-1-methyl-1H-pyrrolo[2,3-b]pyridine
CID 60147980
3-[2-(5-fluoro-1-methyl-1H-indol-3-yl)-1,3-thiazol-4-yl]-1-methyl-1H-pyrrolo[2,3-b]pyridine
CID 60147996
4-(1-Methylindol-3-yl)-2-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole
CID 155809792
2-[5-Fluoro-1-(4-piperidin-1-ylbutyl)indol-3-yl]-4-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole;hydrobromide
CID 168287387
2-[5-Fluoro-1-(4-piperidin-1-ylbutyl)indol-3-yl]-4-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole
CID 155815191
2-[5-Fluoro-1-(3-piperidin-1-ylpropyl)indol-3-yl]-4-(1-methylpyrrolo[2,3-b]pyridin-3-yl)-1,3-thiazole
CID 155815426
4-(1-Methylpyrrolo[2,3-b]pyridin-3-yl)-2-[1-(4-piperidin-1-ylbutyl)indol-3-yl]-1,3-thiazole
CID 155812157
4-(1-Methylpyrrolo[2,3-b]pyridin-3-yl)-2-[1-(3-piperidin-1-ylpropyl)indol-3-yl]-1,3-thiazole
CID 155813254
9-(5-Pyrido[2,3-b]indol-9-ylthiophen-2-yl)pyrido[2,3-b]indole
CID 122381679
Bis(copper(1+));bis(2-(1,8-naphthyridin-2-yl)-1,3-thiazole);diperchlorate
CID 139170064
2-(5-Imidazo[2,1-b][1,3]benzothiazol-2-yl-3,4-dimethylthieno[2,3-b]thiophen-2-yl)imidazo[2,1-b][1,3]benzothiazole
CID 139236157
3-[2-(1,5-dimethyl-1H-indol-3-yl)-1,3-thiazol-4-yl]-1-methyl-1H-pyrrolo[2,3-b]pyridine
CID 60147983

Frequently Asked Questions

What is the IUPAC name of bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))?
The IUPAC name of bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+)) (CID 176621917) is bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+)).
What is the SMILES notation for bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))?
The canonical SMILES for bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+)) is Cc1ccc2c(n1)[n-]c1ccccc12.Cc1ccc2c(n1)[n-]c1ccccc12.[Pt+2].[Pt+2].[c-]1ccccc1-c1nccs1.[c-]1ccccc1-c1nccs1.
What is the InChIKey of bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))?
The InChIKey is HYDCBRCTAFBMFB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H9N2.2C9H6NS.2Pt/c2*1-8-6-7-10-9-4-2-3-5-11(9)14-12(10)13-8;2*1-2-4-8(5-3-1)9-10-6-7-11-9;;/h2*2-7H,1H3;2*1-4,6-7H;;/q4*-1;2*+2.
What are the key properties of bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+))?
bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+)) has a molecular weight of 1073.03 g/mol, XLogP of 10.52, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-methylpyrido[2,3-b]indol-9-ide);bis(2-phenyl-1,3-thiazole);bis(platinum(2+)) is sourced from PubChem (CID 176621917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).