phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+)

C34H23N6PPtS2 — CID 58704698

IUPACphenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+)
SMILES[Pt+2].c1ccc([N-]c2ccccc2-c2nsc(P(c3ccccc3)c3nc(-c4ccccc4[N-]c4ccccc4)ns3)n2)cc1
InChIInChI=1S/C34H23N6PS2.Pt/c1-4-14-24(15-5-1)35-29-22-12-10-20-27(29)31-37-33(42-39-31)41(26-18-8-3-9-19-26)34-38-32(40-43-34)28-21-11-13-23-30(28)36-25-16-6-2-7-17-25;/h1-23H;/q-2;+2
InChIKeyWLUIYBOUTPTSOH-UHFFFAOYSA-N
MW805.79 g/mol
LogP9.15
Rot. Bonds9

About phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+)

phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+) (PubChem CID 58704698) has the molecular formula C34H23N6PPtS2 and a molecular weight of 805.79 g/mol. Its IUPAC name is phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+).

Molecular Properties

Compound Namephenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+)
PubChem CID58704698
Molecular FormulaC34H23N6PPtS2
Molecular Weight805.79 g/mol
Exact Mass805.08
IUPAC Namephenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+)
SMILES[Pt+2].c1ccc([N-]c2ccccc2-c2nsc(P(c3ccccc3)c3nc(-c4ccccc4[N-]c4ccccc4)ns3)n2)cc1
InChIInChI=1S/C34H23N6PS2.Pt/c1-4-14-24(15-5-1)35-29-22-12-10-20-27(29)31-37-33(42-39-31)41(26-18-8-3-9-19-26)34-38-32(40-43-34)28-21-11-13-23-30(28)36-25-16-6-2-7-17-25;/h1-23H;/q-2;+2
InChIKeyWLUIYBOUTPTSOH-UHFFFAOYSA-N
XLogP9.15
TPSA79.76 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500805.79
LogP ≤ 59.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+) with MolForge

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Related Compounds

tris(triphenylphosphane);trihydrochloride
CID 173282987
tetrakis(triphenylphosphane);dihydrochloride
CID 172855409
triphenylphosphane;octahydrochloride
CID 172751742
nickel;tetrakis(triphenylphosphane)
CID 161328494
bis([2-(2-diphenylphosphanylphenyl)phenyl]-diphenylphosphane);hydrate
CID 87203660
carbanide;platinum(2+);bis(triphenylphosphane)
CID 11007152
lithium bis(2-diphenylphosphanylphenyl)azanide
CID 87445331
triphenylphosphane
CID 139056248
dilithium;phenyl-[2-(1-phenylbenzotriazol-4-yl)phenyl]azanide
CID 138975971
[2-(5-chloro-1,2,4-thiadiazol-3-yl)phenyl]-methyl-diphenylphosphanium
CID 172682585
tris(triphenylphosphane);hydrobromide
CID 172722268
palladium;bis(triphenylphosphane)
CID 10122028

Frequently Asked Questions

What is the IUPAC name of phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+)?
The IUPAC name of phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+) (CID 58704698) is phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+).
What is the SMILES notation for phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+)?
The canonical SMILES for phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+) is [Pt+2].c1ccc([N-]c2ccccc2-c2nsc(P(c3ccccc3)c3nc(-c4ccccc4[N-]c4ccccc4)ns3)n2)cc1.
What is the InChIKey of phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+)?
The InChIKey is WLUIYBOUTPTSOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H23N6PS2.Pt/c1-4-14-24(15-5-1)35-29-22-12-10-20-27(29)31-37-33(42-39-31)41(26-18-8-3-9-19-26)34-38-32(40-43-34)28-21-11-13-23-30(28)36-25-16-6-2-7-17-25;/h1-23H;/q-2;+2.
What are the key properties of phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+)?
phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+) has a molecular weight of 805.79 g/mol, XLogP of 9.15, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[2-[5-[phenyl-[3-(2-phenylazanidylphenyl)-1,2,4-thiadiazol-5-yl]phosphanyl]-1,2,4-thiadiazol-3-yl]phenyl]azanide;platinum(2+) is sourced from PubChem (CID 58704698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).