rel-(3R,4R)-1-[(3-cyanophenyl)methyl]-N-cyclopropyl-4-(methoxymethyl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-[(3-cyanophenyl)methyl]-N-cyclopropyl-4-(methoxymethyl)pyrrolidine-3-carboxamide
rel-(3R,4R)-1-[(3-cyanophenyl)methyl]-N-cyclopropyl-4-(methoxymethyl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-6086 |
| Compound Name: | rel-(3R,4R)-1-[(3-cyanophenyl)methyl]-N-cyclopropyl-4-(methoxymethyl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 313.4 |
| Molecular Formula: | C18 H23 N3 O2 |
| Smiles: | COC[C@@H]1CN(Cc2cccc(C#N)c2)C[C@H]1C(NC1CC1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.2393 |
| logD: | -0.0439 |
| logSw: | -2.2473 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.154 |
| InChI Key: | HRHIRJXODSNSRW-WBVHZDCISA-N |