6-[(azocan-1-yl)methyl]-2-(propan-2-yl)pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-[(azocan-1-yl)methyl]-2-(propan-2-yl)pyrimidin-4(3H)-one
6-[(azocan-1-yl)methyl]-2-(propan-2-yl)pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | P198-0098 |
| Compound Name: | 6-[(azocan-1-yl)methyl]-2-(propan-2-yl)pyrimidin-4(3H)-one |
| Molecular Weight: | 263.38 |
| Molecular Formula: | C15 H25 N3 O |
| Smiles: | CC(C)C1NC(C=C(CN2CCCCCCC2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4687 |
| logD: | -0.273 |
| logSw: | -2.7145 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.632 |
| InChI Key: | ZZSYWECAMJNNBP-UHFFFAOYSA-N |