Structure Info
- Chemspace ID
- CSMB03496554050 (Enamine MADE)
- CAS
- 2680690-79-1
- IUPAC Name
- 5-acetamido-3-(2-hydroxyethoxy)-1-methyl-1H-pyrazole-4-carboxylic acid
- Mol formula
- C9H13N3O5
- Mol weight
- 243 Da
- Catalog Number(s)
- EN300-28277531
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.22
- Heavy atoms count
- 17
- Rotatable bond count
- 5
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.44444444444444
- Polar surface area (Å)
- 114
- Hydrogen bond acceptors count
- 6
- Hydrogen bond donors count
- 3
- Zoom the structure
- CSMB03496554050
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