[2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone

C38H38O2Te2 — CID 102312176

IUPAC[2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone
SMILESCC(C)(C)/C(=C/c1ccccc1C(=O)c1ccccc1)[Te][Te]/C(=C\c1ccccc1C(=O)c1ccccc1)C(C)(C)C
InChIInChI=1S/C38H38O2Te2/c1-37(2,3)33(25-29-21-13-15-23-31(29)35(39)27-17-9-7-10-18-27)41-42-34(38(4,5)6)26-30-22-14-16-24-32(30)36(40)28-19-11-8-12-20-28/h7-26H,1-6H3/b33-25-,34-26-
InChIKeyZRXMAQUKKGFFIM-LYWFMZLMSA-N
MW781.92 g/mol
LogP8.95
Rot. Bonds9

About [2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone

[2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone (PubChem CID 102312176) has the molecular formula C38H38O2Te2 and a molecular weight of 781.92 g/mol. Its IUPAC name is [2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone.

Molecular Properties

Compound Name[2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone
PubChem CID102312176
Molecular FormulaC38H38O2Te2
Molecular Weight781.92 g/mol
Exact Mass786.10
IUPAC Name[2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone
SMILESCC(C)(C)/C(=C/c1ccccc1C(=O)c1ccccc1)[Te][Te]/C(=C\c1ccccc1C(=O)c1ccccc1)C(C)(C)C
InChIInChI=1S/C38H38O2Te2/c1-37(2,3)33(25-29-21-13-15-23-31(29)35(39)27-17-9-7-10-18-27)41-42-34(38(4,5)6)26-30-22-14-16-24-32(30)36(40)28-19-11-8-12-20-28/h7-26H,1-6H3/b33-25-,34-26-
InChIKeyZRXMAQUKKGFFIM-LYWFMZLMSA-N
XLogP8.95
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500781.92
LogP ≤ 58.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(2-hydroxypropan-2-yl)phenyl]-phenylmethanone
CID 15254692
(E)-4-(2-benzoylphenyl)but-3-en-2-one
CID 135039520
2,2-dimethylpropane;diphenylmethanone
CID 159191976
[2-(ethylamino)phenyl]-phenylmethanone
CID 3661027
[2-(but-2-enylamino)phenyl]-phenylmethanone
CID 163414634
[2-(3-methylbuta-1,3-dienyl)phenyl]-phenylmethanone
CID 173151442
(2-aminophenyl)-phenylmethanone
CID 158207972
(2-aminophenyl)-phenylmethanone;diphenylmethanone
CID 90112643
(2S)-2-(2-benzoylanilino)propanal
CID 90887440
1-[2-(2-methylprop-1-enyl)phenyl]-2-phenylethane-1,2-dione
CID 102031724
2,3-dibenzoylbenzaldehyde
CID 54496315
[2-(1,1-dihydroxyethoxy)phenyl]-phenylmethanone
CID 139905658

Frequently Asked Questions

What is the IUPAC name of [2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone?
The IUPAC name of [2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone (CID 102312176) is [2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone.
What is the SMILES notation for [2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone?
The canonical SMILES for [2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone is CC(C)(C)/C(=C/c1ccccc1C(=O)c1ccccc1)[Te][Te]/C(=C\c1ccccc1C(=O)c1ccccc1)C(C)(C)C.
What is the InChIKey of [2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone?
The InChIKey is ZRXMAQUKKGFFIM-LYWFMZLMSA-N. The full InChI is InChI=1S/C38H38O2Te2/c1-37(2,3)33(25-29-21-13-15-23-31(29)35(39)27-17-9-7-10-18-27)41-42-34(38(4,5)6)26-30-22-14-16-24-32(30)36(40)28-19-11-8-12-20-28/h7-26H,1-6H3/b33-25-,34-26-.
What are the key properties of [2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone?
[2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone has a molecular weight of 781.92 g/mol, XLogP of 8.95, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(Z)-2-[[(Z)-1-(2-benzoylphenyl)-3,3-dimethylbut-1-en-2-yl]ditellanyl]-3,3-dimethylbut-1-enyl]phenyl]-phenylmethanone is sourced from PubChem (CID 102312176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).