N-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioyl)thiophene-2-carboxamide
Chemical Structure Depiction of
N-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioyl)thiophene-2-carboxamide
N-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioyl)thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 8017-3395 |
| Compound Name: | N-(8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carbothioyl)thiophene-2-carboxamide |
| Molecular Weight: | 359.47 |
| Molecular Formula: | C17 H17 N3 O2 S2 |
| Smiles: | C1[C@H]2CN(C[C@H]1CN1C2=CC=CC1=O)C(NC(c1cccs1)=O)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6711 |
| logD: | 2.6711 |
| logSw: | -3.0327 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.033 |
| InChI Key: | FSZXCILCDCIPLM-NEPJUHHUSA-N |