rel-(3R,4R)-1-(4-chloro-2-methoxybenzoyl)-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-(4-chloro-2-methoxybenzoyl)-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
rel-(3R,4R)-1-(4-chloro-2-methoxybenzoyl)-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-3579 |
| Compound Name: | rel-(3R,4R)-1-(4-chloro-2-methoxybenzoyl)-4-(methoxymethyl)-N-methylpyrrolidine-3-carboxamide |
| Molecular Weight: | 340.8 |
| Molecular Formula: | C16 H21 Cl N2 O4 |
| Smiles: | CNC([C@@H]1CN(C[C@H]1COC)C(c1ccc(cc1OC)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3695 |
| logD: | 1.3695 |
| logSw: | -2.6566 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.009 |
| InChI Key: | IXYCKLWHYHMJRI-GXFFZTMASA-N |