Molecule

ID:119028

General Information
Structure
MolImage
Molecular Formula
C₁₅H₁₉NO₅
Molecular Mass
293.31506
Exact Mass
293.12632271
Charge
0
InChI
InChI=1S/C15H19NO5/c1-4-13(18)16(2)6-5-10-7-12-15(21-9-20-12)14(19-3)11(10)8-17/h7-8H,4-6,9H2,1-3H3
InChIKey
UCGMSEDPWQIOHX-UHFFFAOYSA-N
Canonic Smiles
CCC(=O)N(CCc1cc2OCOc2c(c1C=O)OC)C
Isomeric Smiles
c12c(c(c(cc1OCO2)CCN(C(=O)CC)C)C=O)OC
Calculated Properties
JChem
H Acceptors
5
H Donor
0
LogD (pH = 5.5)
1.3087981
LogD (pH = 7.4)
1.3087986
Log P
1.3087986
Molar Refractivity
77.0679
Polarizability
29.520185
Polar Surface Area
65.07
Rotatable Bonds
6
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
Navigation
N-[2-(6-formyl-7-methoxy-2H-1,3-benzodioxol-5-yl)ethyl]-N-methylpropanamide|N-[2-(6-formyl-7-methoxy-2H-1,3-benzodioxol-5-yl)ethyl]-N-methylpropanamide|N-(2-(6-formyl-7-methoxybenzo[d][1,3]dioxol-5-... | Molfinder