2-{4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}-N-(3,4,5-trimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}-N-(3,4,5-trimethoxyphenyl)acetamide
2-{4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}-N-(3,4,5-trimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | F512-0647 |
| Compound Name: | 2-{4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}-N-(3,4,5-trimethoxyphenyl)acetamide |
| Molecular Weight: | 445.45 |
| Molecular Formula: | C22 H24 F N3 O6 |
| Smiles: | [H]C(C(Nc1cc(c(c(c1)OC)OC)OC)=O)N1CCN(Cc2ccc(cc2)F)C(C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2504 |
| logD: | 1.2501 |
| logSw: | -2.3916 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.411 |
| InChI Key: | SXAYKGDWFWXAQS-UHFFFAOYSA-N |