azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum

C16H19N4Pt-3 — CID 157187880

IUPACazanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum
SMILESCC.[CH3-].[NH2-].[Pt].c1ccc2c(c1)nc1[n-]c3ccccc3n12
InChIInChI=1S/C13H8N3.C2H6.CH3.H2N.Pt/c1-3-7-11-9(5-1)14-13-15-10-6-2-4-8-12(10)16(11)13;1-2;;;/h1-8H;1-2H3;1H3;1H2;/q-1;;2*-1;
InChIKeySOESYCMCPBIEFL-UHFFFAOYSA-N
MW462.43 g/mol
LogP4.79
Rot. Bonds

About azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum

azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum (PubChem CID 157187880) has the molecular formula C16H19N4Pt-3 and a molecular weight of 462.43 g/mol. Its IUPAC name is azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum.

Molecular Properties

Compound Nameazanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum
PubChem CID157187880
Molecular FormulaC16H19N4Pt-3
Molecular Weight462.43 g/mol
Exact Mass462.13
IUPAC Nameazanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum
SMILESCC.[CH3-].[NH2-].[Pt].c1ccc2c(c1)nc1[n-]c3ccccc3n12
InChIInChI=1S/C13H8N3.C2H6.CH3.H2N.Pt/c1-3-7-11-9(5-1)14-13-15-10-6-2-4-8-12(10)16(11)13;1-2;;;/h1-8H;1-2H3;1H3;1H2;/q-1;;2*-1;
InChIKeySOESYCMCPBIEFL-UHFFFAOYSA-N
XLogP4.79
TPSA64.90 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500462.43
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

benzimidazolo[1,2-a]benzimidazol-6-ide;chromium
CID 140944538
benzimidazolo[1,2-a]benzimidazol-6-ide;[1,3-bis[2,6-di(propan-2-yl)phenyl]-2H-imidazo[4,5-c]pyridin-3-ium-2-id-6-yl]-triphenylsilane;gold
CID 169045486
silver 2-methylbenzimidazol-1-ide
CID 46784053
N-ethyl-N-([1,2,4]thiadiazolo[4,5-a]benzimidazol-1-ylmethyl)ethanamine
CID 23303056
4-ethyl-2-(4-methylphenyl)-[1,3,5]triazino[1,2-a]benzimidazole
CID 14245741
ethane;4-methyl-17-thia-1,8,15,19-tetrazahexacyclo[16.7.0.02,7.08,16.09,14.020,25]pentacosa-2(7),3,5,9,11,13,15,18,20,22,24-undecaene
CID 145383764
1-(benzenesulfonyl)-2-methylbenzimidazole
CID 3468368
ethane;4-methyl-14,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaene
CID 145358346
1,2,3-trimethylimidazo[1,2-a]benzimidazole
CID 157483248
[(1-ethylbenzimidazol-2-yl)-(trimethyl-λ4-sulfanyl)methyl]-trimethyl-λ4-sulfane
CID 89375402
1-ethyl-2-propan-2-ylbenzimidazole
CID 962427
ethane;7,14,25,32-tetrazaundecacyclo[21.13.2.22,5.03,19.04,16.06,14.08,13.020,37.024,32.026,31.034,38]tetraconta-1(36),2,4,6,8,10,12,16,18,20(37),21,23(38),24,26,28,30,34,39-octadecaene-15,33-dione
CID 90702606

Frequently Asked Questions

What is the IUPAC name of azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum?
The IUPAC name of azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum (CID 157187880) is azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum.
What is the SMILES notation for azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum?
The canonical SMILES for azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum is CC.[CH3-].[NH2-].[Pt].c1ccc2c(c1)nc1[n-]c3ccccc3n12.
What is the InChIKey of azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum?
The InChIKey is SOESYCMCPBIEFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8N3.C2H6.CH3.H2N.Pt/c1-3-7-11-9(5-1)14-13-15-10-6-2-4-8-12(10)16(11)13;1-2;;;/h1-8H;1-2H3;1H3;1H2;/q-1;;2*-1;.
What are the key properties of azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum?
azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum has a molecular weight of 462.43 g/mol, XLogP of 4.79, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azanide;benzimidazolo[1,2-a]benzimidazol-6-ide;carbanide;ethane;platinum is sourced from PubChem (CID 157187880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).