(11aR)-3-(1-ethyl-1H-pyrazole-5-carbonyl)decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
(11aR)-3-(1-ethyl-1H-pyrazole-5-carbonyl)decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-(1-ethyl-1H-pyrazole-5-carbonyl)decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N107-0266 |
| Compound Name: | (11aR)-3-(1-ethyl-1H-pyrazole-5-carbonyl)decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 316.4 |
| Molecular Formula: | C17 H24 N4 O2 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)C(c1ccnn1CC)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.6115 |
| logD: | 0.6115 |
| logSw: | -1.4637 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.209 |
| InChI Key: | LNDLPWIGRBOYJW-BFHYXJOUSA-N |