ethyl [3-methyl-2,6-dioxo-8-(piperidin-1-yl)-1,2,3,6-tetrahydro-7H-purin-7-yl]acetate
Chemical Structure Depiction of
ethyl [3-methyl-2,6-dioxo-8-(piperidin-1-yl)-1,2,3,6-tetrahydro-7H-purin-7-yl]acetate
ethyl [3-methyl-2,6-dioxo-8-(piperidin-1-yl)-1,2,3,6-tetrahydro-7H-purin-7-yl]acetate
Compound characteristics
| Compound ID: | D226-0005 |
| Compound Name: | ethyl [3-methyl-2,6-dioxo-8-(piperidin-1-yl)-1,2,3,6-tetrahydro-7H-purin-7-yl]acetate |
| Molecular Weight: | 335.36 |
| Molecular Formula: | C15 H21 N5 O4 |
| Smiles: | CCOC(Cn1c2C(NC(N(C)c2nc1N1CCCCC1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7302 |
| logD: | 1.7301 |
| logSw: | -2.2333 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.042 |
| InChI Key: | ROBUPFGQFAOOEW-UHFFFAOYSA-N |