2-[2-chloro-6-(thiomorpholin-4-yl)-9H-purin-9-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[2-chloro-6-(thiomorpholin-4-yl)-9H-purin-9-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
2-[2-chloro-6-(thiomorpholin-4-yl)-9H-purin-9-yl]-N-(3,4,5-trimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | Y043-5662 |
| Compound Name: | 2-[2-chloro-6-(thiomorpholin-4-yl)-9H-purin-9-yl]-N-(3,4,5-trimethoxyphenyl)acetamide |
| Molecular Weight: | 478.96 |
| Molecular Formula: | C20 H23 Cl N6 O4 S |
| Smiles: | COc1cc(cc(c1OC)OC)NC(Cn1cnc2c(nc(nc12)[Cl])N1CCSCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3667 |
| logD: | 2.3659 |
| logSw: | -3.4138 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.87 |
| InChI Key: | UFILGGRCYQYBCO-UHFFFAOYSA-N |