benzyl 2-{[2-(2,6-dimethylanilino)-2-oxo-1-phenylethyl]carbamoyl}pyrrolidine-1-carboxylate
Chemical Structure Depiction of
benzyl 2-{[2-(2,6-dimethylanilino)-2-oxo-1-phenylethyl]carbamoyl}pyrrolidine-1-carboxylate
benzyl 2-{[2-(2,6-dimethylanilino)-2-oxo-1-phenylethyl]carbamoyl}pyrrolidine-1-carboxylate
Compound characteristics
| Compound ID: | C094-0246 |
| Compound Name: | benzyl 2-{[2-(2,6-dimethylanilino)-2-oxo-1-phenylethyl]carbamoyl}pyrrolidine-1-carboxylate |
| Molecular Weight: | 485.58 |
| Molecular Formula: | C29 H31 N3 O4 |
| Smiles: | Cc1cccc(C)c1NC(C(c1ccccc1)NC(C1CCCN1C(=O)OCc1ccccc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4179 |
| logD: | 4.4177 |
| logSw: | -4.3668 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.836 |
| InChI Key: | KQBYSAVKFWTUPO-UHFFFAOYSA-N |