azanylidyne(trichloro)osmium;bis(1H-indazole)

C14H12Cl3N5Os — CID 58437558

IUPACazanylidyne(trichloro)osmium;bis(1H-indazole)
SMILESN#[Os](Cl)(Cl)Cl.c1ccc2[nH]ncc2c1.c1ccc2[nH]ncc2c1
InChIInChI=1S/2C7H6N2.3ClH.N.Os/c2*1-2-4-7-6(3-1)5-8-9-7;;;;;/h2*1-5H,(H,8,9);3*1H;;/q;;;;;;+3/p-3
InChIKeyCETOEYGGLGWGKE-UHFFFAOYSA-K
MW546.87 g/mol
LogP5.21
Rot. Bonds

About azanylidyne(trichloro)osmium;bis(1H-indazole)

azanylidyne(trichloro)osmium;bis(1H-indazole) (PubChem CID 58437558) has the molecular formula C14H12Cl3N5Os and a molecular weight of 546.87 g/mol. Its IUPAC name is azanylidyne(trichloro)osmium;bis(1H-indazole).

Molecular Properties

Compound Nameazanylidyne(trichloro)osmium;bis(1H-indazole)
PubChem CID58437558
Molecular FormulaC14H12Cl3N5Os
Molecular Weight546.87 g/mol
Exact Mass546.98
IUPAC Nameazanylidyne(trichloro)osmium;bis(1H-indazole)
SMILESN#[Os](Cl)(Cl)Cl.c1ccc2[nH]ncc2c1.c1ccc2[nH]ncc2c1
InChIInChI=1S/2C7H6N2.3ClH.N.Os/c2*1-2-4-7-6(3-1)5-8-9-7;;;;;/h2*1-5H,(H,8,9);3*1H;;/q;;;;;;+3/p-3
InChIKeyCETOEYGGLGWGKE-UHFFFAOYSA-K
XLogP5.21
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500546.87
LogP ≤ 55.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1H-Indazol-6-amine
CID 81423
1H-Indazol-5-amine
CID 88012
1H-Indazole
CID 9221
5-Iodo-1H-indazole
CID 21894739
6-(trifluoromethyl)-1H-indazole
CID 21455599
7-Methyl-1H-indazole
CID 820797
4-Methyl-1H-indazole
CID 820806
It-139
CID 25134754
4-iodo-1H-indazole
CID 24728219
6-Methyl-1H-indazole
CID 12639191
5-(1H-1,2,3-triazol-4-yl)-1H-indazole
CID 25165860
5-[2-(trifluoromethyl)phenyl]-1H-indazole
CID 90645447

Frequently Asked Questions

What is the IUPAC name of azanylidyne(trichloro)osmium;bis(1H-indazole)?
The IUPAC name of azanylidyne(trichloro)osmium;bis(1H-indazole) (CID 58437558) is azanylidyne(trichloro)osmium;bis(1H-indazole).
What is the SMILES notation for azanylidyne(trichloro)osmium;bis(1H-indazole)?
The canonical SMILES for azanylidyne(trichloro)osmium;bis(1H-indazole) is N#[Os](Cl)(Cl)Cl.c1ccc2[nH]ncc2c1.c1ccc2[nH]ncc2c1.
What is the InChIKey of azanylidyne(trichloro)osmium;bis(1H-indazole)?
The InChIKey is CETOEYGGLGWGKE-UHFFFAOYSA-K. The full InChI is InChI=1S/2C7H6N2.3ClH.N.Os/c2*1-2-4-7-6(3-1)5-8-9-7;;;;;/h2*1-5H,(H,8,9);3*1H;;/q;;;;;;+3/p-3.
What are the key properties of azanylidyne(trichloro)osmium;bis(1H-indazole)?
azanylidyne(trichloro)osmium;bis(1H-indazole) has a molecular weight of 546.87 g/mol, XLogP of 5.21, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azanylidyne(trichloro)osmium;bis(1H-indazole) is sourced from PubChem (CID 58437558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).