rel-(8aR,11aS)-1-[(benzyloxy)acetyl]decahydrocyclopenta[e][1,4,8]oxadiazecin-8(5H)-one
Chemical Structure Depiction of
rel-(8aR,11aS)-1-[(benzyloxy)acetyl]decahydrocyclopenta[e][1,4,8]oxadiazecin-8(5H)-one
rel-(8aR,11aS)-1-[(benzyloxy)acetyl]decahydrocyclopenta[e][1,4,8]oxadiazecin-8(5H)-one
Compound characteristics
| Compound ID: | S798-0131 |
| Compound Name: | rel-(8aR,11aS)-1-[(benzyloxy)acetyl]decahydrocyclopenta[e][1,4,8]oxadiazecin-8(5H)-one |
| Molecular Weight: | 346.43 |
| Molecular Formula: | C19 H26 N2 O4 |
| Smiles: | C1C[C@H]2[C@@H](C1)C(NCCOCCN2C(COCc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.9368 |
| logD: | 0.9368 |
| logSw: | -1.8872 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.689 |
| InChI Key: | PVSMHRRWKYUYLR-SJORKVTESA-N |