dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine)

C36H48Cl2N12Os — CID 144800267

IUPACdichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine)
SMILESCl[Os]Cl.c1cc(N2CCNCC2)cc(-c2cc(N3CCNCC3)ccn2)n1.c1cc(N2CCNCC2)cc(-c2cc(N3CCNCC3)ccn2)n1
InChIInChI=1S/2C18H24N6.2ClH.Os/c2*1-3-21-17(13-15(1)23-9-5-19-6-10-23)18-14-16(2-4-22-18)24-11-7-20-8-12-24;;;/h2*1-4,13-14,19-20H,5-12H2;2*1H;/q;;;;+2/p-2
InChIKeyAKVHCWVIWOSUSZ-UHFFFAOYSA-L
MW910.00 g/mol
LogP3.30
Rot. Bonds6

About dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine)

dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine) (PubChem CID 144800267) has the molecular formula C36H48Cl2N12Os and a molecular weight of 910.00 g/mol. Its IUPAC name is dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine).

Molecular Properties

Compound Namedichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine)
PubChem CID144800267
Molecular FormulaC36H48Cl2N12Os
Molecular Weight910.00 g/mol
Exact Mass910.31
IUPAC Namedichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine)
SMILESCl[Os]Cl.c1cc(N2CCNCC2)cc(-c2cc(N3CCNCC3)ccn2)n1.c1cc(N2CCNCC2)cc(-c2cc(N3CCNCC3)ccn2)n1
InChIInChI=1S/2C18H24N6.2ClH.Os/c2*1-3-21-17(13-15(1)23-9-5-19-6-10-23)18-14-16(2-4-22-18)24-11-7-20-8-12-24;;;/h2*1-4,13-14,19-20H,5-12H2;2*1H;/q;;;;+2/p-2
InChIKeyAKVHCWVIWOSUSZ-UHFFFAOYSA-L
XLogP3.30
TPSA112.64 Ų
H-Bond Donors4
H-Bond Acceptors12
Rotatable Bonds6
Heavy Atoms51
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500910.00
LogP ≤ 53.30
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1012

Analyze dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine) with MolForge

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Related Compounds

4-pyrrolidin-1-yl-2-(4-pyrrolidin-1-yl-2-pyridinyl)pyridine
CID 11601769
4-piperazin-1-ylpyridine-2-carbonitrile;dihydrochloride
CID 154825612
1-[2-(trifluoromethyl)-4-pyridinyl]piperazine;dihydrochloride
CID 154825576
2-(4-piperazin-1-yl-2-pyridinyl)propan-2-ol
CID 146276335
4-(1,4-diazepan-1-yl)pyridine-2-carboxylic acid
CID 61402818
2-chloro-4-(3-fluoro-5-piperazin-1-ylphenyl)pyrimidine
CID 59588234
4-(1,4-diazepan-1-yl)-N-(quinoxalin-6-ylmethyl)pyridin-2-amine
CID 177366069
N-(2-methylpropyl)-4-piperazin-1-ylpyridin-2-amine;dihydrochloride
CID 67087405
7-piperazin-1-yl-4-[(7-piperazin-1-ylquinolin-4-yl)disulfanyl]quinoline
CID 139772933
7-piperazin-1-yl-3-pyridin-2-ylimidazo[1,5-a]pyridine
CID 117236205
6-(1,4-diazepan-1-yl)quinoline
CID 62635992
4-(4-piperazin-1-ylphenyl)pyridin-2-amine
CID 147694887

Frequently Asked Questions

What is the IUPAC name of dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine)?
The IUPAC name of dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine) (CID 144800267) is dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine).
What is the SMILES notation for dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine)?
The canonical SMILES for dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine) is Cl[Os]Cl.c1cc(N2CCNCC2)cc(-c2cc(N3CCNCC3)ccn2)n1.c1cc(N2CCNCC2)cc(-c2cc(N3CCNCC3)ccn2)n1.
What is the InChIKey of dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine)?
The InChIKey is AKVHCWVIWOSUSZ-UHFFFAOYSA-L. The full InChI is InChI=1S/2C18H24N6.2ClH.Os/c2*1-3-21-17(13-15(1)23-9-5-19-6-10-23)18-14-16(2-4-22-18)24-11-7-20-8-12-24;;;/h2*1-4,13-14,19-20H,5-12H2;2*1H;/q;;;;+2/p-2.
What are the key properties of dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine)?
dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine) has a molecular weight of 910.00 g/mol, XLogP of 3.30, 6 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for dichloroosmium;bis(1-[2-(4-piperazin-1-yl-2-pyridinyl)-4-pyridinyl]piperazine) is sourced from PubChem (CID 144800267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).