N-butyl-2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]benzamide
Chemical Structure Depiction of
N-butyl-2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]benzamide
N-butyl-2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]benzamide
Compound characteristics
| Compound ID: | Y031-7006 |
| Compound Name: | N-butyl-2-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamido]benzamide |
| Molecular Weight: | 412.45 |
| Molecular Formula: | C20 H24 N6 O4 |
| Smiles: | CCCCNC(c1ccccc1NC(Cn1cnc2c1C(N(C)C(N2C)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3438 |
| logD: | 1.3431 |
| logSw: | -2.5706 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.938 |
| InChI Key: | QULQKBGXZAPEPQ-UHFFFAOYSA-N |