(3E,4R)-4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(3,4-dimethoxyphenyl)methylidene]oxolan-2-one
Structure Info
- Chemspace ID
- CSSS00137410083 (In-Stock Screening Compounds)
- MFCD
- MFCD20274730
- IUPAC Name
- (3E,4R)-4-[(2H-1,3-benzodioxol-5-yl)methyl]-3-[(3,4-dimethoxyphenyl)methylidene]oxolan-2-one
- Mol formula
- C21H20O6
- Mol weight
- 368 Da
- Catalog Number(s)
- AA00G657, AG00G67Z, AR00G6WZ, ArZ-UP485148, BBP01791, BD298873, CD32000480, CFN97234, CSC137410083, FS-9013, HY-N3429, JH470236, TN4374, W1841, Y3306276, ZX-CY006924, ZXC320794
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.69
- Heavy atoms count
- 27
- Rotatable bond count
- 5
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.285
- Polar surface area (Å)
- 63
- Hydrogen bond acceptors count
- 5
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSS00137410083
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