rel-(3R,4S)-4-acetamido-N-methyl-1-(2-methylbenzene-1-sulfonyl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4S)-4-acetamido-N-methyl-1-(2-methylbenzene-1-sulfonyl)pyrrolidine-3-carboxamide
rel-(3R,4S)-4-acetamido-N-methyl-1-(2-methylbenzene-1-sulfonyl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S963-3946 |
| Compound Name: | rel-(3R,4S)-4-acetamido-N-methyl-1-(2-methylbenzene-1-sulfonyl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 339.41 |
| Molecular Formula: | C15 H21 N3 O4 S |
| Smiles: | CC(N[C@H]1CN(C[C@@H]1C(NC)=O)S(c1ccccc1C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -0.3682 |
| logD: | -0.3682 |
| logSw: | -2.2824 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.525 |
| InChI Key: | FKKLHBCMLQOJHK-CHWSQXEVSA-N |