rel-(3R,4R)-N-(3,5-dimethylphenyl)-3-(methoxymethyl)-4-(pyridin-2-yl)pyrrolidine-1-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-N-(3,5-dimethylphenyl)-3-(methoxymethyl)-4-(pyridin-2-yl)pyrrolidine-1-carboxamide
rel-(3R,4R)-N-(3,5-dimethylphenyl)-3-(methoxymethyl)-4-(pyridin-2-yl)pyrrolidine-1-carboxamide
Compound characteristics
| Compound ID: | S831-3542 |
| Compound Name: | rel-(3R,4R)-N-(3,5-dimethylphenyl)-3-(methoxymethyl)-4-(pyridin-2-yl)pyrrolidine-1-carboxamide |
| Molecular Weight: | 339.44 |
| Molecular Formula: | C20 H25 N3 O2 |
| Smiles: | Cc1cc(C)cc(c1)NC(N1C[C@@H](COC)[C@@H](C1)c1ccccn1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.944 |
| logD: | 2.9438 |
| logSw: | -3.3086 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.14 |
| InChI Key: | AKVVHVIAHJMEBT-FUHWJXTLSA-N |