N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-3-fluoro-4-methoxybenzamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-3-fluoro-4-methoxybenzamide
N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-3-fluoro-4-methoxybenzamide
Compound characteristics
| Compound ID: | S639-0559 |
| Compound Name: | N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(pyrimidin-4-yl)pyrrolidin-3-yl]-3-fluoro-4-methoxybenzamide |
| Molecular Weight: | 373.43 |
| Molecular Formula: | C19 H24 F N5 O2 |
| Smiles: | CN(C)C[C@@H]1CN(C[C@H]1NC(c1ccc(c(c1)F)OC)=O)c1ccncn1 |
| Stereo: | RELATIVE |
| logP: | 1.6056 |
| logD: | -0.533 |
| logSw: | -1.9054 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.432 |
| InChI Key: | QVKHJCJPJZMVLX-HOCLYGCPSA-N |