ethyl 3-amino-4-(3,4-dimethoxyphenyl)-2-ethylbutanoate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 3-amino-4-(3,4-dimethoxyphenyl)-2-ethylbutanoate--hydrogen chloride (1/1)
ethyl 3-amino-4-(3,4-dimethoxyphenyl)-2-ethylbutanoate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | C430-0021 |
| Compound Name: | ethyl 3-amino-4-(3,4-dimethoxyphenyl)-2-ethylbutanoate--hydrogen chloride (1/1) |
| Molecular Weight: | 331.84 |
| Molecular Formula: | C16 H25 N O4 |
| Salt: | HCl |
| Smiles: | CCC(C(Cc1ccc(c(c1)OC)OC)N)C(=O)OCC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9969 |
| logD: | 1.0692 |
| logSw: | -2.5546 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.042 |
| InChI Key: | VCGJTHBSTHEDDJ-UHFFFAOYSA-N |