(Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one

C33H26O2Pb — CID 16683210

IUPAC(Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one
SMILESO=C(/C=C(\O[Pb](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C15H12O2.3C6H5.Pb/c16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;3*1-2-4-6-5-3-1;/h1-11,16H;3*1-5H;/q;;;;+1/p-1/b14-11-;;;;
InChIKeyFENYMSNLGWHJKX-VDOWVRHSSA-M
MW661.77 g/mol
LogP5.59
Rot. Bonds8

About (Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one

(Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one (PubChem CID 16683210) has the molecular formula C33H26O2Pb and a molecular weight of 661.77 g/mol. Its IUPAC name is (Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one.

Molecular Properties

Compound Name(Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one
PubChem CID16683210
Molecular FormulaC33H26O2Pb
Molecular Weight661.77 g/mol
Exact Mass662.17
IUPAC Name(Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one
SMILESO=C(/C=C(\O[Pb](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C15H12O2.3C6H5.Pb/c16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;3*1-2-4-6-5-3-1;/h1-11,16H;3*1-5H;/q;;;;+1/p-1/b14-11-;;;;
InChIKeyFENYMSNLGWHJKX-VDOWVRHSSA-M
XLogP5.59
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500661.77
LogP ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one?
The IUPAC name of (Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one (CID 16683210) is (Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one.
What is the SMILES notation for (Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one?
The canonical SMILES for (Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one is O=C(/C=C(\O[Pb](c1ccccc1)(c1ccccc1)c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of (Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one?
The InChIKey is FENYMSNLGWHJKX-VDOWVRHSSA-M. The full InChI is InChI=1S/C15H12O2.3C6H5.Pb/c16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13;3*1-2-4-6-5-3-1;/h1-11,16H;3*1-5H;/q;;;;+1/p-1/b14-11-;;;;.
What are the key properties of (Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one?
(Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one has a molecular weight of 661.77 g/mol, XLogP of 5.59, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,3-diphenyl-3-triphenylplumbyloxyprop-2-en-1-one is sourced from PubChem (CID 16683210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).