phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum

C24H16NOPt- — CID 59538579

IUPACphenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum
SMILESO=C(c1ccccc1)c1ccc(-c2c[c-]c(-c3ccccn3)cc2)cc1.[Pt]
InChIInChI=1S/C24H16NO.Pt/c26-24(21-6-2-1-3-7-21)22-15-11-19(12-16-22)18-9-13-20(14-10-18)23-8-4-5-17-25-23;/h1-13,15-17H;/q-1;
InChIKeySNJBTNVNOHBAPX-UHFFFAOYSA-N
MW529.48 g/mol
LogP5.44
Rot. Bonds4

About phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum

phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum (PubChem CID 59538579) has the molecular formula C24H16NOPt- and a molecular weight of 529.48 g/mol. Its IUPAC name is phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum.

Molecular Properties

Compound Namephenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum
PubChem CID59538579
Molecular FormulaC24H16NOPt-
Molecular Weight529.48 g/mol
Exact Mass529.09
IUPAC Namephenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum
SMILESO=C(c1ccccc1)c1ccc(-c2c[c-]c(-c3ccccn3)cc2)cc1.[Pt]
InChIInChI=1S/C24H16NO.Pt/c26-24(21-6-2-1-3-7-21)22-15-11-19(12-16-22)18-9-13-20(14-10-18)23-8-4-5-17-25-23;/h1-13,15-17H;/q-1;
InChIKeySNJBTNVNOHBAPX-UHFFFAOYSA-N
XLogP5.44
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500529.48
LogP ≤ 55.44
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

bis(2-(4-phenylbenzene-6-id-1-yl)pyridine);platinum(2+)
CID 58939535
2-[4-(4-but-2-en-2-ylphenyl)benzene-6-id-1-yl]pyridine;iridium(3+);bis(2-phenylpyridine)
CID 59005128
4-[6-[5-(4-carboxyphenyl)-2-pyridinyl]-3-pyridinyl]benzoic acid;iridium;2-phenylpyridine
CID 170523980
phenyl-(4-phenylphenyl)methanone
CID 155775877
acetic acid;bis(iridium);bis(2-phenylpyridine)
CID 58163263
2-[2-[3,5-bis[2-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]phenyl]phenyl]-5-pyridin-2-yl-4H-pyridin-4-ide;iridium(3+)
CID 153320031
(Z)-1-[2-[3,5-bis[2-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]phenyl]phenyl]-5-hydroxyhex-4-en-3-one;iridium
CID 154588816
tris(iridium(3+));tris(2-phenylpyridine);hexakis(9-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]carbazole)
CID 162273497
(4-phenylphenyl)-(2-pyridin-2-yl-1-benzofuran-3-yl)methanone
CID 122208629
iridium(3+);2-phenyl-6-[4-[2-[3-[2-[2-(4-phenylphenyl)-4-pyridin-2-ylbenzene-5-id-1-yl]phenyl]-5-[2-[4-(6-phenyl-2-pyridinyl)benzene-5-id-1-yl]phenyl]phenyl]phenyl]benzene-6-id-1-yl]pyridine
CID 153458434
(2,3-dipyridin-2-ylquinoxalin-6-yl)-phenylmethanone
CID 54672430
1-[4-[5-[4,6-bis(4-tert-butylphenyl)-1,3,5-triazin-2-yl]-2-pyridinyl]benzene-5-id-1-yl]ethanone;iridium(3+);bis(2-phenylpyridine)
CID 59156291

Frequently Asked Questions

What is the IUPAC name of phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum?
The IUPAC name of phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum (CID 59538579) is phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum.
What is the SMILES notation for phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum?
The canonical SMILES for phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum is O=C(c1ccccc1)c1ccc(-c2c[c-]c(-c3ccccn3)cc2)cc1.[Pt].
What is the InChIKey of phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum?
The InChIKey is SNJBTNVNOHBAPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16NO.Pt/c26-24(21-6-2-1-3-7-21)22-15-11-19(12-16-22)18-9-13-20(14-10-18)23-8-4-5-17-25-23;/h1-13,15-17H;/q-1;.
What are the key properties of phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum?
phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum has a molecular weight of 529.48 g/mol, XLogP of 5.44, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[4-(4-pyridin-2-ylbenzene-5-id-1-yl)phenyl]methanone;platinum is sourced from PubChem (CID 59538579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).