6-[(azepan-1-yl)methyl]-2-phenylpyrimidin-4(3H)-one
Chemical Structure Depiction of
6-[(azepan-1-yl)methyl]-2-phenylpyrimidin-4(3H)-one
6-[(azepan-1-yl)methyl]-2-phenylpyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | P198-0016 |
| Compound Name: | 6-[(azepan-1-yl)methyl]-2-phenylpyrimidin-4(3H)-one |
| Molecular Weight: | 283.37 |
| Molecular Formula: | C17 H21 N3 O |
| Smiles: | C1CCCN(CC1)CC1=CC(NC(c2ccccc2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3643 |
| logD: | 2.3643 |
| logSw: | -2.8437 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.361 |
| InChI Key: | UGWOIPRIVYGQEZ-UHFFFAOYSA-N |