2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-N-[4-hydroxy-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-N-[4-hydroxy-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-N-[4-hydroxy-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | 7275-0047 |
| Compound Name: | 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)-N-[4-hydroxy-3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]acetamide |
| Molecular Weight: | 460.45 |
| Molecular Formula: | C23 H20 N6 O5 |
| Smiles: | Cc1ccc2c(c1)nc(c1cc(ccc1O)NC(Cn1cnc3C(N(C)C(N(C)c13)=O)=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 3.2729 |
| logD: | 3.2726 |
| logSw: | -3.2235 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.412 |
| InChI Key: | UDUGMUIUPXDZGB-UHFFFAOYSA-N |