(11aR)-3-[(thiophen-3-yl)acetyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
(11aR)-3-[(thiophen-3-yl)acetyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-[(thiophen-3-yl)acetyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N107-0063 |
| Compound Name: | (11aR)-3-[(thiophen-3-yl)acetyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 318.44 |
| Molecular Formula: | C17 H22 N2 O2 S |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)C(Cc1ccsc1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.738 |
| logD: | 1.738 |
| logSw: | -2.0942 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.611 |
| InChI Key: | SEZPKQRXBWLWTO-RRFJBIMHSA-N |