(11aR)-3-{3-[4-(4-chlorophenyl)piperazine-1-carbonyl]pyridin-2-yl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
(11aR)-3-{3-[4-(4-chlorophenyl)piperazine-1-carbonyl]pyridin-2-yl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-{3-[4-(4-chlorophenyl)piperazine-1-carbonyl]pyridin-2-yl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N114-0046 |
| Compound Name: | (11aR)-3-{3-[4-(4-chlorophenyl)piperazine-1-carbonyl]pyridin-2-yl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 494.04 |
| Molecular Formula: | C27 H32 Cl N5 O2 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)c1c(cccn1)C(N1CCN(CC1)c1ccc(cc1)[Cl])=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.3458 |
| logD: | 3.3458 |
| logSw: | -3.8706 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.814 |
| InChI Key: | LQUXPOFOLSYMHG-DCLXLUIPSA-N |