trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate

C20H24O4Si — CID 10594452

IUPACtrimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate
SMILESCOc1ccccc1/C=C(/C(=O)O[Si](C)(C)C)c1ccccc1OC
InChIInChI=1S/C20H24O4Si/c1-22-18-12-8-6-10-15(18)14-17(20(21)24-25(3,4)5)16-11-7-9-13-19(16)23-2/h6-14H,1-5H3/b17-14+
InChIKeyQTLNWLAVSFCMAN-SAPNQHFASA-N
MW356.49 g/mol
LogP4.62
Rot. Bonds6

About trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate

trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate (PubChem CID 10594452) has the molecular formula C20H24O4Si and a molecular weight of 356.49 g/mol. Its IUPAC name is trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate.

Molecular Properties

Compound Nametrimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate
PubChem CID10594452
Molecular FormulaC20H24O4Si
Molecular Weight356.49 g/mol
Exact Mass356.14
IUPAC Nametrimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate
SMILESCOc1ccccc1/C=C(/C(=O)O[Si](C)(C)C)c1ccccc1OC
InChIInChI=1S/C20H24O4Si/c1-22-18-12-8-6-10-15(18)14-17(20(21)24-25(3,4)5)16-11-7-9-13-19(16)23-2/h6-14H,1-5H3/b17-14+
InChIKeyQTLNWLAVSFCMAN-SAPNQHFASA-N
XLogP4.62
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.49
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate 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

trimethylsilyl (E)-3-(2,3-dimethoxyphenyl)-2-trimethylsilyloxyprop-2-enoate
CID 5372919
(Z)-2-(2-methoxyphenyl)-3-(2-pentoxyphenyl)prop-2-enoic acid
CID 83954614
(E)-4-(2-methoxyphenyl)-3-pyridin-2-ylbut-3-en-2-one
CID 67850877
[2-(2-methoxyphenyl)-1-trimethylsilylethenyl]-trimethylsilane
CID 102296582
methyl (Z)-2-methoxy-3-(2-methoxyphenyl)prop-2-enoate
CID 10867868
(Z)-3-(2-methoxyphenyl)-2-(5-methyl-1,3,4-oxadiazol-2-yl)prop-2-enoic acid
CID 35752791
2-(2-methoxyphenyl)-3-(2-nitrophenyl)prop-2-enoic acid
CID 54099002
(2-amino-2-oxoethyl) 3-(2-methoxyphenyl)-2-phenylprop-2-enoate
CID 5025744
methyl (2Z)-2-[(2-methoxyphenyl)methylidene]-3-oxobutanoate
CID 70489657
methyl 2-[(E)-1-fluoro-2-(2-methoxyphenyl)ethenyl]benzoate
CID 146798772
(2E,3E)-2,3-bis[(2-methoxyphenyl)methylidene]butanedial
CID 87977206
(Z)-3-(2,4-dichlorophenyl)-2-(2-methoxyphenyl)prop-2-enoic acid
CID 83954743

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate?
The IUPAC name of trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate (CID 10594452) is trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate.
What is the SMILES notation for trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate?
The canonical SMILES for trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate is COc1ccccc1/C=C(/C(=O)O[Si](C)(C)C)c1ccccc1OC.
What is the InChIKey of trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate?
The InChIKey is QTLNWLAVSFCMAN-SAPNQHFASA-N. The full InChI is InChI=1S/C20H24O4Si/c1-22-18-12-8-6-10-15(18)14-17(20(21)24-25(3,4)5)16-11-7-9-13-19(16)23-2/h6-14H,1-5H3/b17-14+.
What are the key properties of trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate?
trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate has a molecular weight of 356.49 g/mol, XLogP of 4.62, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl (E)-2,3-bis(2-methoxyphenyl)prop-2-enoate is sourced from PubChem (CID 10594452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).