(11aR)-3-[1-(2,4-dimethoxybenzoyl)piperidin-4-yl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
(11aR)-3-[1-(2,4-dimethoxybenzoyl)piperidin-4-yl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-[1-(2,4-dimethoxybenzoyl)piperidin-4-yl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N109-0052 |
| Compound Name: | (11aR)-3-[1-(2,4-dimethoxybenzoyl)piperidin-4-yl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 441.57 |
| Molecular Formula: | C25 H35 N3 O4 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)C1CCN(CC1)C(c1ccc(cc1OC)OC)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.1698 |
| logD: | -1.0458 |
| logSw: | -2.7143 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.388 |
| InChI Key: | KLKWIUPNGKWERR-JBYIUTFZSA-N |