3-(1H-benzimidazol-2-yl)-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]propanamide
Chemical Structure Depiction of
3-(1H-benzimidazol-2-yl)-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]propanamide
3-(1H-benzimidazol-2-yl)-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]propanamide
Compound characteristics
| Compound ID: | S639-3462 |
| Compound Name: | 3-(1H-benzimidazol-2-yl)-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]propanamide |
| Molecular Weight: | 393.51 |
| Molecular Formula: | C18 H27 N5 O3 S |
| Smiles: | CN(C)C[C@@H]1CN(C[C@H]1NC(CCc1nc2ccccc2[nH]1)=O)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.3571 |
| logD: | -1.6251 |
| logSw: | -2.2332 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.238 |
| InChI Key: | AVHGKTSHFVKMPJ-CZUORRHYSA-N |