rel-(3R,4R)-4-(phenoxymethyl)-1-(pyrimidine-4-carbonyl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-4-(phenoxymethyl)-1-(pyrimidine-4-carbonyl)pyrrolidine-3-carboxamide
rel-(3R,4R)-4-(phenoxymethyl)-1-(pyrimidine-4-carbonyl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S836-0836 |
| Compound Name: | rel-(3R,4R)-4-(phenoxymethyl)-1-(pyrimidine-4-carbonyl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 326.35 |
| Molecular Formula: | C17 H18 N4 O3 |
| Smiles: | C1[C@@H](COc2ccccc2)[C@@H](CN1C(c1ccncn1)=O)C(N)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.4406 |
| logD: | 0.4406 |
| logSw: | -1.4247 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.596 |
| InChI Key: | GHIMWZBWSSCAEE-GXTWGEPZSA-N |