N-(2-hydroxyethyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Chemical Structure Depiction of
N-(2-hydroxyethyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
N-(2-hydroxyethyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide
Compound characteristics
| Compound ID: | 8020-0881 |
| Compound Name: | N-(2-hydroxyethyl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioamide |
| Molecular Weight: | 293.39 |
| Molecular Formula: | C14 H19 N3 O2 S |
| Smiles: | C1C2CN(CC1C1=CC=CC(N1C2)=O)C(NCCO)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.9975 |
| logD: | 0.9975 |
| logSw: | -1.4665 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 44.926 |
| InChI Key: | OALPIGGGHVQMRS-UHFFFAOYSA-N |