N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-3,5-dimethoxybenzamide
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | S639-3397 |
| Compound Name: | N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-3,5-dimethoxybenzamide |
| Molecular Weight: | 385.48 |
| Molecular Formula: | C17 H27 N3 O5 S |
| Smiles: | CN(C)C[C@@H]1CN(C[C@H]1NC(c1cc(cc(c1)OC)OC)=O)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.6363 |
| logD: | -1.2884 |
| logSw: | -2.1233 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.258 |
| InChI Key: | QQVLUKAZTTUFFO-CZUORRHYSA-N |