N-(4,6-dimethylpyrimidin-2-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboximidamide
Chemical Structure Depiction of
N-(4,6-dimethylpyrimidin-2-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboximidamide
N-(4,6-dimethylpyrimidin-2-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboximidamide
Compound characteristics
| Compound ID: | 8018-9808 |
| Compound Name: | N-(4,6-dimethylpyrimidin-2-yl)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocine-3(4H)-carboximidamide |
| Molecular Weight: | 338.41 |
| Molecular Formula: | C18 H22 N6 O |
| Smiles: | Cc1cc(C)nc(NC(=N)N2CC3CC(C2)C2=CC=CC(N2C3)=O)n1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.6441 |
| logD: | -3.4519 |
| logSw: | -2.1113 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.278 |
| InChI Key: | WHMYZWIFHZKVFY-UHFFFAOYSA-N |