(11aR)-3-{2-oxo-2-[4-(prop-2-en-1-yl)piperazin-1-yl]ethyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
(11aR)-3-{2-oxo-2-[4-(prop-2-en-1-yl)piperazin-1-yl]ethyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-{2-oxo-2-[4-(prop-2-en-1-yl)piperazin-1-yl]ethyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N108-0170 |
| Compound Name: | (11aR)-3-{2-oxo-2-[4-(prop-2-en-1-yl)piperazin-1-yl]ethyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 360.5 |
| Molecular Formula: | C20 H32 N4 O2 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(CC(N1CCN(CC1)CC=C)=O)C2)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.1533 |
| logD: | 0.0452 |
| logSw: | -0.1595 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.387 |
| InChI Key: | IXWJEDKBLOCGDP-RCCFBDPRSA-N |