2-[(7-butyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(7-butyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
2-[(7-butyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | 8013-9375 |
| Compound Name: | 2-[(7-butyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide |
| Molecular Weight: | 431.51 |
| Molecular Formula: | C20 H25 N5 O4 S |
| Smiles: | CCCCn1c2C(N(C)C(N(C)c2nc1SCC(Nc1ccccc1OC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3258 |
| logD: | 3.3257 |
| logSw: | -3.6911 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.346 |
| InChI Key: | OIZZYDRCOIJOSJ-UHFFFAOYSA-N |