Structure Info
- Chemspace ID
- CSMB00000170951 (Enamine MADE)
- MFCD
- MFCD02858950
- IUPAC Name
- 2-ethyl-1-propyl-1H-1,3-benzodiazole
- Mol formula
- C12H16N2
- Mol weight
- 188 Da
- Catalog Number(s)
- BBV-38716050, CSC000170951, F0414-0017
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.19
- Heavy atoms count
- 14
- Rotatable bond count
- 3
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.416
- Polar surface area (Å)
- 18
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00000170951
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