(11aR)-3-[5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyridin-2-yl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Chemical Structure Depiction of
(11aR)-3-[5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyridin-2-yl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
(11aR)-3-[5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyridin-2-yl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Compound characteristics
| Compound ID: | N115-0020 |
| Compound Name: | (11aR)-3-[5-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)pyridin-2-yl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one |
| Molecular Weight: | 440.54 |
| Molecular Formula: | C24 H32 N4 O4 |
| Smiles: | [H][C@@]12CCCC(N2C[C@@H]2C[C@@H]1CN(C2)c1ccc(cn1)C(N1CCC2(CC1)OCCO2)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.2574 |
| logD: | 1.2573 |
| logSw: | -1.6146 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.611 |
| InChI Key: | XBSBZEVFTMYMBW-MISYRCLQSA-N |