2-(cyclohex-1-en-1-yl)-1-[rel-(3R,4S)-3-(methoxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]ethan-1-one
Chemical Structure Depiction of
2-(cyclohex-1-en-1-yl)-1-[rel-(3R,4S)-3-(methoxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]ethan-1-one
2-(cyclohex-1-en-1-yl)-1-[rel-(3R,4S)-3-(methoxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | S824-3436 |
| Compound Name: | 2-(cyclohex-1-en-1-yl)-1-[rel-(3R,4S)-3-(methoxymethyl)-4-(pyridin-4-yl)pyrrolidin-1-yl]ethan-1-one |
| Molecular Weight: | 314.43 |
| Molecular Formula: | C19 H26 N2 O2 |
| Smiles: | COC[C@@H]1CN(C[C@H]1c1ccncc1)C(CC1CCCCC=1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.5318 |
| logD: | 2.4245 |
| logSw: | -2.736 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.365 |
| InChI Key: | LYTDMRPTIJJYTL-ROUUACIJSA-N |