2-(4-chlorophenyl)-1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]ethan-1-one
2-(4-chlorophenyl)-1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S823-4044 |
| Compound Name: | 2-(4-chlorophenyl)-1-[rel-(3R,4S)-3-(dimethylamino)-4-(hydroxymethyl)pyrrolidin-1-yl]ethan-1-one |
| Molecular Weight: | 296.79 |
| Molecular Formula: | C15 H21 Cl N2 O2 |
| Smiles: | CN(C)[C@@H]1CN(C[C@H]1CO)C(Cc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3101 |
| logD: | -0.4933 |
| logSw: | -2.1503 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.618 |
| InChI Key: | PKIOUXWRSSRILP-GXTWGEPZSA-N |