ethyl {4-[3-amino-1-(2H-1,3-benzodioxol-5-yl)-3-oxopropyl]-5-oxo-2,5-dihydro-1H-pyrazol-3-yl}acetate
Chemical Structure Depiction of
ethyl {4-[3-amino-1-(2H-1,3-benzodioxol-5-yl)-3-oxopropyl]-5-oxo-2,5-dihydro-1H-pyrazol-3-yl}acetate
ethyl {4-[3-amino-1-(2H-1,3-benzodioxol-5-yl)-3-oxopropyl]-5-oxo-2,5-dihydro-1H-pyrazol-3-yl}acetate
Compound characteristics
| Compound ID: | 8020-8493 |
| Compound Name: | ethyl {4-[3-amino-1-(2H-1,3-benzodioxol-5-yl)-3-oxopropyl]-5-oxo-2,5-dihydro-1H-pyrazol-3-yl}acetate |
| Molecular Weight: | 361.35 |
| Molecular Formula: | C17 H19 N3 O6 |
| Smiles: | CCOC(CC1=C(C(CC(N)=O)c2ccc3c(c2)OCO3)C(NN1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4184 |
| logD: | 0.4183 |
| logSw: | -1.9885 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 112.19 |
| InChI Key: | IJASDLCDCJOGMW-SNVBAGLBSA-N |