Structure Info
- Chemspace ID
- CSMB00150709538 (Enamine MADE)
- CAS
- 869472-70-8
- MFCD
- MFCD07345671
- IUPAC Name
- ethyl 2-[(2Z)-3-[(5-acetyl-2-ethoxyphenyl)methyl]-4-oxo-1,3-thiazolidin-2-ylidene]acetate
- Mol formula
- C18H21NO5S
- Mol weight
- 363 Da
- Catalog Number(s)
- BD00971644, CS-0347720, CSC150709538, EN300-14460, HY-W302877
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.13
- Heavy atoms count
- 25
- Rotatable bond count
- 8
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.388
- Polar surface area (Å)
- 73
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00150709538
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