osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine)

C44H32N4Os+2 — CID 159449942

IUPACosmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine)
SMILES[Os+2].c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1.c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1
InChIInChI=1S/2C22H16N2.Os/c2*1-3-7-17(8-4-1)19-11-13-23-21(15-19)22-16-20(12-14-24-22)18-9-5-2-6-10-18;/h2*1-16H;/q;;+2
InChIKeyLTFYXCXMCSWOBE-UHFFFAOYSA-N
MW807.00 g/mol
LogP10.95
Rot. Bonds6

About osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine)

osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine) (PubChem CID 159449942) has the molecular formula C44H32N4Os+2 and a molecular weight of 807.00 g/mol. Its IUPAC name is osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine).

Molecular Properties

Compound Nameosmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine)
PubChem CID159449942
Molecular FormulaC44H32N4Os+2
Molecular Weight807.00 g/mol
Exact Mass808.22
IUPAC Nameosmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine)
SMILES[Os+2].c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1.c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1
InChIInChI=1S/2C22H16N2.Os/c2*1-3-7-17(8-4-1)19-11-13-23-21(15-19)22-16-20(12-14-24-22)18-9-5-2-6-10-18;/h2*1-16H;/q;;+2
InChIKeyLTFYXCXMCSWOBE-UHFFFAOYSA-N
XLogP10.95
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms49
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500807.00
LogP ≤ 510.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine)?
The IUPAC name of osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine) (CID 159449942) is osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine).
What is the SMILES notation for osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine)?
The canonical SMILES for osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine) is [Os+2].c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1.c1ccc(-c2ccnc(-c3cc(-c4ccccc4)ccn3)c2)cc1.
What is the InChIKey of osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine)?
The InChIKey is LTFYXCXMCSWOBE-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H16N2.Os/c2*1-3-7-17(8-4-1)19-11-13-23-21(15-19)22-16-20(12-14-24-22)18-9-5-2-6-10-18;/h2*1-16H;/q;;+2.
What are the key properties of osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine)?
osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine) has a molecular weight of 807.00 g/mol, XLogP of 10.95, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for osmium(2+);bis(4-phenyl-2-(4-phenyl-2-pyridinyl)pyridine) is sourced from PubChem (CID 159449942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).