5-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}thiophene-2-carboxamide
Chemical Structure Depiction of
5-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}thiophene-2-carboxamide
5-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | S639-1325 |
| Compound Name: | 5-chloro-N-{rel-(3R,4S)-4-[(dimethylamino)methyl]-1-[(pyridin-2-yl)methyl]pyrrolidin-3-yl}thiophene-2-carboxamide |
| Molecular Weight: | 378.92 |
| Molecular Formula: | C18 H23 Cl N4 O S |
| Smiles: | CN(C)C[C@@H]1CN(Cc2ccccn2)C[C@H]1NC(c1ccc(s1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.9553 |
| logD: | -0.1114 |
| logSw: | -2.6532 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.989 |
| InChI Key: | WMXDLGKTVVQRDP-ZFWWWQNUSA-N |