(11aR)-3-[4-(4-cyclohexylpiperazine-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-cyclohexylpiperazine-1-carbonyl)piperidine-1-carbonyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-[4-(4-cyclohexylpiperazine-1-carbonyl)piperidine-1-carbonyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N117-0029 |
| Compound Name: | (11aR)-3-[4-(4-cyclohexylpiperazine-1-carbonyl)piperidine-1-carbonyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 499.7 |
| Molecular Formula: | C28 H45 N5 O3 |
| Smiles: | [H][C@@]12CCCC(N2CC2C[C@@H]1CN(C2)C(N1CCC(CC1)C(N1CCN(CC1)C1CCCCC1)=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.2768 |
| logD: | 1.8641 |
| logSw: | -2.0435 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.668 |
| InChI Key: | LTMVKPASIKFZDX-QQKQFIJSSA-N |