(11aR)-3-{4-[4-(2-methylpropyl)piperazine-1-carbonyl]piperidine-1-carbonyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
(11aR)-3-{4-[4-(2-methylpropyl)piperazine-1-carbonyl]piperidine-1-carbonyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-{4-[4-(2-methylpropyl)piperazine-1-carbonyl]piperidine-1-carbonyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N117-0093 |
| Compound Name: | (11aR)-3-{4-[4-(2-methylpropyl)piperazine-1-carbonyl]piperidine-1-carbonyl}decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 473.66 |
| Molecular Formula: | C26 H43 N5 O3 |
| Smiles: | [H][C@@]12CCCC(N2CC2C[C@@H]1CN(C2)C(N1CCC(CC1)C(N1CCN(CC1)CC(C)C)=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.7137 |
| logD: | 1.2502 |
| logSw: | -1.7343 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.386 |
| InChI Key: | XXPUMLXZWDWKMI-YMPZKCBVSA-N |