(11aR)-3-{1-[(3-methylphenoxy)acetyl]piperidin-4-yl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
(11aR)-3-{1-[(3-methylphenoxy)acetyl]piperidin-4-yl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-{1-[(3-methylphenoxy)acetyl]piperidin-4-yl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N109-0152 |
| Compound Name: | (11aR)-3-{1-[(3-methylphenoxy)acetyl]piperidin-4-yl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 425.57 |
| Molecular Formula: | C25 H35 N3 O3 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)C1CCN(CC1)C(COc1cccc(C)c1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.3599 |
| logD: | -0.9718 |
| logSw: | -2.4794 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.185 |
| InChI Key: | CSISHBYUMMJUPR-TXTKFYIRSA-N |