2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum

C28H17N2O2Pt- — CID 166562222

IUPAC2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum
SMILESOc1cccc2c3ccccc3c3ccc(Oc4cccc(-c5[c-]cccc5)n4)nc3c12.[Pt]
InChIInChI=1S/C28H17N2O2.Pt/c31-24-14-6-12-21-19-10-4-5-11-20(19)22-16-17-26(30-28(22)27(21)24)32-25-15-7-13-23(29-25)18-8-2-1-3-9-18;/h1-8,10-17,31H;/q-1;
InChIKeyDAYJZTCRKTZKCM-UHFFFAOYSA-N
MW608.53 g/mol
LogP6.90
Rot. Bonds3

About 2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum

2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum (PubChem CID 166562222) has the molecular formula C28H17N2O2Pt- and a molecular weight of 608.53 g/mol. Its IUPAC name is 2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum.

Molecular Properties

Compound Name2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum
PubChem CID166562222
Molecular FormulaC28H17N2O2Pt-
Molecular Weight608.53 g/mol
Exact Mass608.09
IUPAC Name2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum
SMILESOc1cccc2c3ccccc3c3ccc(Oc4cccc(-c5[c-]cccc5)n4)nc3c12.[Pt]
InChIInChI=1S/C28H17N2O2.Pt/c31-24-14-6-12-21-19-10-4-5-11-20(19)22-16-17-26(30-28(22)27(21)24)32-25-15-7-13-23(29-25)18-8-2-1-3-9-18;/h1-8,10-17,31H;/q-1;
InChIKeyDAYJZTCRKTZKCM-UHFFFAOYSA-N
XLogP6.90
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms33
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500608.53
LogP ≤ 56.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

chloronickel;2,6-di(phenyl)pyridine
CID 153499161
15-[3-[(6-phenyl-2-pyridinyl)oxy]benzene-2-id-1-yl]-17-thia-14-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene;platinum(2+)
CID 164939815
nickel;2-[6-(6-phenyl-2-pyridinyl)-2-pyridinyl]phenol
CID 153499066
CID 168721177
CID 168721177
CID 153499114
CID 153499114
platinum;2-[4-(6-pyridin-2-yloxy-2-pyridinyl)-3H-pyridin-3-id-2-yl]phenol
CID 153280343
2-[2,2-bis(4-naphthalen-1-ylnaphthalen-1-yl)-1-(6-phenyl-2-pyridinyl)ethenyl]-6-phenylpyridine;platinum(2+)
CID 155620139
iridium;tris(2-phenylpyridine)
CID 23386734
methane;1-methyltriphenylene;phenylbenzene;bis(yttrium)
CID 172624920
iridium;17-phenyl-16,20-dithia-18-azapentacyclo[12.6.0.02,7.08,13.015,19]icosa-1(14),2,4,6,8,10,12,15(19),17-nonaene;2-phenylpyridine
CID 164757014
bis(chloroiridium(2+));tetrakis(2-phenylpyridine)
CID 54724512
bromonickel;2-phenyl-6-pyridin-2-ylpyridine
CID 153499013

Frequently Asked Questions

What is the IUPAC name of 2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum?
The IUPAC name of 2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum (CID 166562222) is 2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum.
What is the SMILES notation for 2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum?
The canonical SMILES for 2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum is Oc1cccc2c3ccccc3c3ccc(Oc4cccc(-c5[c-]cccc5)n4)nc3c12.[Pt].
What is the InChIKey of 2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum?
The InChIKey is DAYJZTCRKTZKCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H17N2O2.Pt/c31-24-14-6-12-21-19-10-4-5-11-20(19)22-16-17-26(30-28(22)27(21)24)32-25-15-7-13-23(29-25)18-8-2-1-3-9-18;/h1-8,10-17,31H;/q-1;.
What are the key properties of 2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum?
2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum has a molecular weight of 608.53 g/mol, XLogP of 6.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-phenyl-2-pyridinyl)oxy]phenanthro[10,9-b]pyridin-12-ol;platinum is sourced from PubChem (CID 166562222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).