N-cyclohexyl-2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]benzamide
Chemical Structure Depiction of
N-cyclohexyl-2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]benzamide
N-cyclohexyl-2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]benzamide
Compound characteristics
| Compound ID: | Y031-7036 |
| Compound Name: | N-cyclohexyl-2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]benzamide |
| Molecular Weight: | 438.49 |
| Molecular Formula: | C22 H26 N6 O4 |
| Smiles: | CN1C(c2c(ncn2CC(Nc2ccccc2C(NC2CCCCC2)=O)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8744 |
| logD: | 1.8737 |
| logSw: | -2.8203 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.551 |
| InChI Key: | BULIDVGDFXLSHC-UHFFFAOYSA-N |