ethyl 3-[(6-acetyl-2H-1,3-benzodioxol-5-yl)amino]-3-oxopropanoate
Chemical Structure Depiction of
ethyl 3-[(6-acetyl-2H-1,3-benzodioxol-5-yl)amino]-3-oxopropanoate
ethyl 3-[(6-acetyl-2H-1,3-benzodioxol-5-yl)amino]-3-oxopropanoate
Compound characteristics
| Compound ID: | C200-3145 |
| Compound Name: | ethyl 3-[(6-acetyl-2H-1,3-benzodioxol-5-yl)amino]-3-oxopropanoate |
| Molecular Weight: | 293.27 |
| Molecular Formula: | C14 H15 N O6 |
| Smiles: | CCOC(CC(Nc1cc2c(cc1C(C)=O)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9547 |
| logD: | 0.8746 |
| logSw: | -2.0268 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.791 |
| InChI Key: | RMODOMFGXPAWHJ-UHFFFAOYSA-N |