Structure Info
- Chemspace ID
- CSMB00032347631 (Enamine MADE)
- IUPAC Name
- (2,5-dimethylphenyl)methyl 4-amino-3-methylbenzoate
- Mol formula
- C17H19NO2
- Mol weight
- 269 Da
- Catalog Number(s)
- BBV-33049586, CSC032347631, s_1458____25959914____484416
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.41
- Heavy atoms count
- 20
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.23529411764706
- Polar surface area (Å)
- 52
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB00032347631
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