N-[rel-(3R,4S)-1-[(3,4-dimethylphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]-2-methoxyacetamide
Chemical Structure Depiction of
N-[rel-(3R,4S)-1-[(3,4-dimethylphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]-2-methoxyacetamide
N-[rel-(3R,4S)-1-[(3,4-dimethylphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]-2-methoxyacetamide
Compound characteristics
| Compound ID: | S823-5482 |
| Compound Name: | N-[rel-(3R,4S)-1-[(3,4-dimethylphenyl)methyl]-4-(hydroxymethyl)pyrrolidin-3-yl]-2-methoxyacetamide |
| Molecular Weight: | 306.4 |
| Molecular Formula: | C17 H26 N2 O3 |
| Smiles: | Cc1ccc(CN2C[C@H]([C@@H](C2)CO)NC(COC)=O)cc1C |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.1038 |
| logD: | -1.9496 |
| logSw: | -2.1079 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.138 |
| InChI Key: | XAJIXPUNHDYTNO-CVEARBPZSA-N |