osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine

C28H22N8Os — CID 20805461

IUPACosmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine
SMILES[Os].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1cnc(-c2ncccn2)nc1
InChIInChI=1S/2C10H8N2.C8H6N4.Os/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-3-9-7(10-4-1)8-11-5-2-6-12-8;/h2*1-8H;1-6H;
InChIKeyFKFDHNHQQLGXOB-UHFFFAOYSA-N
MW660.77 g/mol
LogP5.22
Rot. Bonds3

About osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine

osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine (PubChem CID 20805461) has the molecular formula C28H22N8Os and a molecular weight of 660.77 g/mol. Its IUPAC name is osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine.

Molecular Properties

Compound Nameosmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine
PubChem CID20805461
Molecular FormulaC28H22N8Os
Molecular Weight660.77 g/mol
Exact Mass662.16
IUPAC Nameosmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine
SMILES[Os].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1cnc(-c2ncccn2)nc1
InChIInChI=1S/2C10H8N2.C8H6N4.Os/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-3-9-7(10-4-1)8-11-5-2-6-12-8;/h2*1-8H;1-6H;
InChIKeyFKFDHNHQQLGXOB-UHFFFAOYSA-N
XLogP5.22
TPSA103.12 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500660.77
LogP ≤ 55.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Related Compounds

2,4,6-Tris(2'-pyridyl)-1,3,5-triazine
CID 77258
4-Pyridin-3-yl-2-pyridin-4-yl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine
CID 3431450
2,4-Dipyridin-2-yl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine
CID 5061793
4-(4-Phenethyl-piperazin-1-yl)-10-pyrimidin-2-yl-6,7,8,9-tetrahydro-pyrimido[4,5-b]indolizine
CID 11351150
7-[(1S,4S)-5-pyridin-2-yl-2,5-diazabicyclo[2.2.1]heptan-2-yl]-[1,2,5]thiadiazolo[3,4-d]pyrimidine
CID 118714649
2-Phenyl-3-[[4-[(2-phenylimidazo[1,2-a]pyrimidin-3-yl)methyl]piperazin-1-yl]methyl]imidazo[1,2-a]pyrimidine
CID 122183050
(8aR)-2-(6-pyridin-3-yl-2-pyridin-4-ylpyrimidin-4-yl)-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 155560416
7-(6-pyridin-3-yl-2-pyridin-4-ylpyrimidin-4-yl)-6,8-dihydro-5H-imidazo[1,2-a]pyrazine
CID 155510396
2,4-Dipyridin-2-ylpyrimidine
CID 4383351
Tris(2,2'-bipyridine)nickel dichloride
CID 72193962
9-Phenyl-8-purin-7-ylpurine
CID 155516002
tris(2,2'-bipyridine)iron(II)
CID 6857601

Frequently Asked Questions

What is the IUPAC name of osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine?
The IUPAC name of osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine (CID 20805461) is osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine.
What is the SMILES notation for osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine?
The canonical SMILES for osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine is [Os].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1cnc(-c2ncccn2)nc1.
What is the InChIKey of osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine?
The InChIKey is FKFDHNHQQLGXOB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H8N2.C8H6N4.Os/c2*1-3-7-11-9(5-1)10-6-2-4-8-12-10;1-3-9-7(10-4-1)8-11-5-2-6-12-8;/h2*1-8H;1-6H;.
What are the key properties of osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine?
osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine has a molecular weight of 660.77 g/mol, XLogP of 5.22, 3 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for osmium;bis(2-pyridin-2-ylpyridine);2-pyrimidin-2-ylpyrimidine is sourced from PubChem (CID 20805461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).