methyl {1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
Chemical Structure Depiction of
methyl {1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
methyl {1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate
Compound characteristics
| Compound ID: | C470-0436 |
| Compound Name: | methyl {1,3-dimethyl-8-[(4-methylpiperidin-1-yl)methyl]-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl}acetate |
| Molecular Weight: | 363.41 |
| Molecular Formula: | C17 H25 N5 O4 |
| Smiles: | CC1CCN(CC1)Cc1nc2c(C(N(C)C(N2C)=O)=O)n1CC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 1.2117 |
| logD: | 1.1817 |
| logSw: | -1.2566 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.263 |
| InChI Key: | IUOOPMUYSYFVAM-UHFFFAOYSA-N |