N-(4-ethoxyphenyl)-2-(4-oxo-7,8,9,10-tetrahydro-4H-azepino[1,2-e]purin-3(6H)-yl)acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-(4-oxo-7,8,9,10-tetrahydro-4H-azepino[1,2-e]purin-3(6H)-yl)acetamide
N-(4-ethoxyphenyl)-2-(4-oxo-7,8,9,10-tetrahydro-4H-azepino[1,2-e]purin-3(6H)-yl)acetamide
Compound characteristics
| Compound ID: | E714-0048 |
| Compound Name: | N-(4-ethoxyphenyl)-2-(4-oxo-7,8,9,10-tetrahydro-4H-azepino[1,2-e]purin-3(6H)-yl)acetamide |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C20 H23 N5 O3 |
| Smiles: | CCOc1ccc(cc1)NC(CN1C=Nc2c(C1=O)nc1CCCCCn12)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3526 |
| logD: | 2.3518 |
| logSw: | -2.8606 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.401 |
| InChI Key: | ZJPOKMYVGUSIHQ-UHFFFAOYSA-N |