rel-(8aR,11aS)-1-[(1H-indol-3-yl)acetyl]decahydrocyclopenta[e][1,4,8]oxadiazecin-8(5H)-one
Chemical Structure Depiction of
rel-(8aR,11aS)-1-[(1H-indol-3-yl)acetyl]decahydrocyclopenta[e][1,4,8]oxadiazecin-8(5H)-one
rel-(8aR,11aS)-1-[(1H-indol-3-yl)acetyl]decahydrocyclopenta[e][1,4,8]oxadiazecin-8(5H)-one
Compound characteristics
| Compound ID: | S798-0031 |
| Compound Name: | rel-(8aR,11aS)-1-[(1H-indol-3-yl)acetyl]decahydrocyclopenta[e][1,4,8]oxadiazecin-8(5H)-one |
| Molecular Weight: | 355.44 |
| Molecular Formula: | C20 H25 N3 O3 |
| Smiles: | C1C[C@H]2[C@@H](C1)C(NCCOCCN2C(Cc1c[nH]c2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.3342 |
| logD: | 1.3342 |
| logSw: | -2.0778 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.126 |
| InChI Key: | MSEHTISJSKOKCV-AEFFLSMTSA-N |