platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride

C23H13ClN5Pt+ — CID 71543302

IUPACplatinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride
SMILES[Cl-].[Pt+2].c1ccc(-c2ccc3c(n2)c2ncccc2c2nc4ccccc4nc32)nc1
InChIInChI=1S/C23H13N5.ClH.Pt/c1-2-9-18-17(8-1)26-22-14-6-5-13-25-20(14)21-15(23(22)27-18)10-11-19(28-21)16-7-3-4-12-24-16;;/h1-13H;1H;/q;;+2/p-1
InChIKeyCBIGUQVZGIAWEO-UHFFFAOYSA-M
MW589.92 g/mol
LogP1.94
Rot. Bonds1

About platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride

platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride (PubChem CID 71543302) has the molecular formula C23H13ClN5Pt+ and a molecular weight of 589.92 g/mol. Its IUPAC name is platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride.

Molecular Properties

Compound Nameplatinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride
PubChem CID71543302
Molecular FormulaC23H13ClN5Pt+
Molecular Weight589.92 g/mol
Exact Mass589.05
IUPAC Nameplatinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride
SMILES[Cl-].[Pt+2].c1ccc(-c2ccc3c(n2)c2ncccc2c2nc4ccccc4nc32)nc1
InChIInChI=1S/C23H13N5.ClH.Pt/c1-2-9-18-17(8-1)26-22-14-6-5-13-25-20(14)21-15(23(22)27-18)10-11-19(28-21)16-7-3-4-12-24-16;;/h1-13H;1H;/q;;+2/p-1
InChIKeyCBIGUQVZGIAWEO-UHFFFAOYSA-M
XLogP1.94
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500589.92
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

bis(2-pyridin-2-ylpyridine);quinoxalino[2,3-f][1,10]phenanthroline;ruthenium
CID 76514831
5-pyridin-2-yl-6,9,15,26-tetrazahexacyclo[12.12.0.02,7.08,13.016,25.018,23]hexacosa-1(26),2(7),3,5,8(13),9,11,14,16,18,20,22,24-tridecaene
CID 102037216
quinoxalino[2,3-f][1,7]phenanthroline;quinoxalino[2,3-f][1,10]phenanthroline
CID 118008961
lanthanum(3+);pentane-2,4-dione;6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;nitrate
CID 56837640
bis(pyrazino[2,3-f]quinoxaline);quinoxalino[2,3-f][1,10]phenanthroline;ruthenium(2+)
CID 56973553
3,6-dimethylquinoxalino[2,3-f][1,10]phenanthroline;bis(2-pyridin-2-ylpyridine);ruthenium
CID 140706892
3,8-dipyridin-2-yl-4,7-phenanthroline
CID 91243626
1,10-phenanthroline;2-pyridin-2-ylpyridine;2-quinolin-2-ylquinoline;ruthenium(2+)
CID 138986830
ethane;6,9,15,17,22-pentazapentacyclo[12.8.0.02,7.08,13.016,21]docosa-1(22),2(7),3,5,8(13),9,11,14,16(21),17,19-undecaene
CID 145351041
7-phenyl-2-[6-(6-pyridin-2-yl-2-pyridinyl)-3-pyridinyl]benzo[b][1,10]phenanthroline
CID 139445668
2,3-dipyridin-2-ylquinoxaline;platinum(2+);bis(2-pyridin-2-ylpyridine);ruthenium(2+)
CID 50910408
2-phenyl-7-[4-(2-pyridin-2-ylquinolin-7-yl)phenyl]benzo[b][1,10]phenanthroline;7-[6-(2-pyridin-2-ylquinolin-7-yl)naphthalen-2-yl]benzo[b][1,10]phenanthroline;7-[4-(2-pyridin-2-ylquinolin-7-yl)phenyl]benzo[b][1,10]phenanthroline
CID 158595333

Frequently Asked Questions

What is the IUPAC name of platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride?
The IUPAC name of platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride (CID 71543302) is platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride.
What is the SMILES notation for platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride?
The canonical SMILES for platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride is [Cl-].[Pt+2].c1ccc(-c2ccc3c(n2)c2ncccc2c2nc4ccccc4nc32)nc1.
What is the InChIKey of platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride?
The InChIKey is CBIGUQVZGIAWEO-UHFFFAOYSA-M. The full InChI is InChI=1S/C23H13N5.ClH.Pt/c1-2-9-18-17(8-1)26-22-14-6-5-13-25-20(14)21-15(23(22)27-18)10-11-19(28-21)16-7-3-4-12-24-16;;/h1-13H;1H;/q;;+2/p-1.
What are the key properties of platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride?
platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride has a molecular weight of 589.92 g/mol, XLogP of 1.94, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for platinum(2+);6-pyridin-2-ylquinoxalino[2,3-f][1,10]phenanthroline;chloride is sourced from PubChem (CID 71543302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).