(11aR)-3-[3-(1H-indol-3-yl)propanoyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
(11aR)-3-[3-(1H-indol-3-yl)propanoyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-[3-(1H-indol-3-yl)propanoyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N107-0054 |
| Compound Name: | (11aR)-3-[3-(1H-indol-3-yl)propanoyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 365.47 |
| Molecular Formula: | C22 H27 N3 O2 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)C(CCc1c[nH]c2ccccc12)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.3487 |
| logD: | 2.3487 |
| logSw: | -2.6678 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.464 |
| InChI Key: | BADCZBIQTZAZFH-XAUMDUMWSA-N |