rel-(1R,3R)-2,2-dicyano-3-(3,4-dimethoxyphenyl)cyclopropane-1-carboxamide
Chemical Structure Depiction of
rel-(1R,3R)-2,2-dicyano-3-(3,4-dimethoxyphenyl)cyclopropane-1-carboxamide
rel-(1R,3R)-2,2-dicyano-3-(3,4-dimethoxyphenyl)cyclopropane-1-carboxamide
Compound characteristics
| Compound ID: | 8018-3373 |
| Compound Name: | rel-(1R,3R)-2,2-dicyano-3-(3,4-dimethoxyphenyl)cyclopropane-1-carboxamide |
| Molecular Weight: | 271.27 |
| Molecular Formula: | C14 H13 N3 O3 |
| Smiles: | COc1ccc(cc1OC)[C@@H]1[C@H](C(N)=O)[C@]1(C#N)C#N |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.6624 |
| logD: | 0.6623 |
| logSw: | -1.5878 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.922 |
| InChI Key: | KMNXAZZVZJGUGB-NEPJUHHUSA-N |