2-chloro-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-6-fluorobenzamide
Chemical Structure Depiction of
2-chloro-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-6-fluorobenzamide
2-chloro-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-6-fluorobenzamide
Compound characteristics
| Compound ID: | S639-3306 |
| Compound Name: | 2-chloro-N-[rel-(3R,4S)-4-[(dimethylamino)methyl]-1-(methanesulfonyl)pyrrolidin-3-yl]-6-fluorobenzamide |
| Molecular Weight: | 377.86 |
| Molecular Formula: | C15 H21 Cl F N3 O3 S |
| Smiles: | CN(C)C[C@@H]1CN(C[C@H]1NC(c1c(cccc1[Cl])F)=O)S(C)(=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7697 |
| logD: | -1.155 |
| logSw: | -2.9522 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.17 |
| InChI Key: | QPPFPYAEUCEWSL-GWCFXTLKSA-N |