bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+)

C83H86F3N9OsP2+2 — CID 157266183

IUPACbis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+)
SMILESCC(C)Cc1cc(-c2cc(C(F)(F)F)n[n-]2)ncc1-c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.Cc1cc(-c2cc(CC(C)C)c(-c3ccccc3)cn2)[n-]n1.Cc1cc(-c2cc(CC(C)C)c(-c3ccccc3)cn2)n[nH]1.[Os+2]
InChIInChI=1S/C19H17F3N3.C19H21N3.C19H20N3.2C13H13P.Os/c1-12(2)8-14-9-16(17-10-18(25-24-17)19(20,21)22)23-11-15(14)13-6-4-3-5-7-13;2*1-13(2)9-16-11-18(19-10-14(3)21-22-19)20-12-17(16)15-7-5-4-6-8-15;2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;/h3-7,9-12H,8H2,1-2H3;4-8,10-13H,9H2,1-3H3,(H,21,22);4-8,10-13H,9H2,1-3H3;2*2-11H,1H3;/q-1;;-1;;;+2/p+2
InChIKeyHPTRQHGFJSYQGN-UHFFFAOYSA-P
MW1518.84 g/mol
LogP18.87
Rot. Bonds16

About bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+)

bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+) (PubChem CID 157266183) has the molecular formula C83H86F3N9OsP2+2 and a molecular weight of 1518.84 g/mol. Its IUPAC name is bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+).

Molecular Properties

Compound Namebis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+)
PubChem CID157266183
Molecular FormulaC83H86F3N9OsP2+2
Molecular Weight1518.84 g/mol
Exact Mass1519.60
IUPAC Namebis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+)
SMILESCC(C)Cc1cc(-c2cc(C(F)(F)F)n[n-]2)ncc1-c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.Cc1cc(-c2cc(CC(C)C)c(-c3ccccc3)cn2)[n-]n1.Cc1cc(-c2cc(CC(C)C)c(-c3ccccc3)cn2)n[nH]1.[Os+2]
InChIInChI=1S/C19H17F3N3.C19H21N3.C19H20N3.2C13H13P.Os/c1-12(2)8-14-9-16(17-10-18(25-24-17)19(20,21)22)23-11-15(14)13-6-4-3-5-7-13;2*1-13(2)9-16-11-18(19-10-14(3)21-22-19)20-12-17(16)15-7-5-4-6-8-15;2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;/h3-7,9-12H,8H2,1-2H3;4-8,10-13H,9H2,1-3H3,(H,21,22);4-8,10-13H,9H2,1-3H3;2*2-11H,1H3;/q-1;;-1;;;+2/p+2
InChIKeyHPTRQHGFJSYQGN-UHFFFAOYSA-P
XLogP18.87
TPSA121.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms98
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001518.84
LogP ≤ 518.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+) with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+)?
The IUPAC name of bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+) (CID 157266183) is bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+).
What is the SMILES notation for bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+)?
The canonical SMILES for bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+) is CC(C)Cc1cc(-c2cc(C(F)(F)F)n[n-]2)ncc1-c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.Cc1cc(-c2cc(CC(C)C)c(-c3ccccc3)cn2)[n-]n1.Cc1cc(-c2cc(CC(C)C)c(-c3ccccc3)cn2)n[nH]1.[Os+2].
What is the InChIKey of bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+)?
The InChIKey is HPTRQHGFJSYQGN-UHFFFAOYSA-P. The full InChI is InChI=1S/C19H17F3N3.C19H21N3.C19H20N3.2C13H13P.Os/c1-12(2)8-14-9-16(17-10-18(25-24-17)19(20,21)22)23-11-15(14)13-6-4-3-5-7-13;2*1-13(2)9-16-11-18(19-10-14(3)21-22-19)20-12-17(16)15-7-5-4-6-8-15;2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;/h3-7,9-12H,8H2,1-2H3;4-8,10-13H,9H2,1-3H3,(H,21,22);4-8,10-13H,9H2,1-3H3;2*2-11H,1H3;/q-1;;-1;;;+2/p+2.
What are the key properties of bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+)?
bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+) has a molecular weight of 1518.84 g/mol, XLogP of 18.87, 16 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(methyl(diphenyl)phosphanium);4-(2-methylpropyl)-2-(5-methylpyrazol-2-id-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-2-(5-methyl-1H-pyrazol-3-yl)-5-phenylpyridine;4-(2-methylpropyl)-5-phenyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine;osmium(2+) is sourced from PubChem (CID 157266183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).