2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]-N-propylbenzamide
Chemical Structure Depiction of
2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]-N-propylbenzamide
2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]-N-propylbenzamide
Compound characteristics
| Compound ID: | Y031-7034 |
| Compound Name: | 2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]-N-propylbenzamide |
| Molecular Weight: | 398.42 |
| Molecular Formula: | C19 H22 N6 O4 |
| Smiles: | CCCNC(c1ccccc1NC(Cn1cnc2c1C(N(C)C(N2C)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.757 |
| logD: | 0.7563 |
| logSw: | -2.4598 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.938 |
| InChI Key: | QKJYHHCYRPUHDX-UHFFFAOYSA-N |