ethyl 3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-(2-chlorophenyl)propanoate--oxalic acid (1/1)
Chemical Structure Depiction of
ethyl 3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-(2-chlorophenyl)propanoate--oxalic acid (1/1)
ethyl 3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-(2-chlorophenyl)propanoate--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 8013-4012 |
| Compound Name: | ethyl 3-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-3-(2-chlorophenyl)propanoate--oxalic acid (1/1) |
| Molecular Weight: | 451.86 |
| Molecular Formula: | C19 H20 Cl N O4 |
| Salt: | HOOCCOOH |
| Smiles: | CCOC(CC(c1ccccc1[Cl])NCc1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4916 |
| logD: | 2.8463 |
| logSw: | -3.5966 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.7 |
| InChI Key: | IPGLZCKRRGVLFN-INIZCTEOSA-N |