2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide
Chemical Structure Depiction of
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | Y031-6843 |
| Compound Name: | 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(6-methoxy-1,3-benzothiazol-2-yl)acetamide |
| Molecular Weight: | 400.41 |
| Molecular Formula: | C17 H16 N6 O4 S |
| Smiles: | CN1C(c2c(ncn2CC(Nc2nc3ccc(cc3s2)OC)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8328 |
| logD: | 1.8327 |
| logSw: | -2.7442 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.415 |
| InChI Key: | ZMWSCZGPXLGAKK-UHFFFAOYSA-N |