Structure Info
- Chemspace ID
- CSMB00000704526 (Enamine MADE)
- CAS
- 796078-96-1
- MFCD
- MFCD06371255
- IUPAC Name
- ethyl 2-[(2Z)-3-[(6-chloro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl]-4-oxo-1,3-thiazolidin-2-ylidene]acetate
- Mol formula
- C16H16ClNO5S
- Mol weight
- 370 Da
- Catalog Number(s)
- BD01001963, CS-0347718, CSC000704526, EN300-14463, HY-W302875
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.64
- Heavy atoms count
- 24
- Rotatable bond count
- 5
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.375
- Polar surface area (Å)
- 65
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00000704526
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