(11aR)-3-[3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propanoyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
(11aR)-3-[3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propanoyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-[3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propanoyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N107-0231 |
| Compound Name: | (11aR)-3-[3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propanoyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 358.48 |
| Molecular Formula: | C20 H30 N4 O2 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)C(CCc1c(C)nn(C)c1C)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 0.6046 |
| logD: | 0.6044 |
| logSw: | -0.5437 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.432 |
| InChI Key: | DASDESPGBRXKIF-LZLYRXPVSA-N |