N-[2-(azepan-1-yl)ethyl]-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
N-[2-(azepan-1-yl)ethyl]-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F718-0637 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 418.55 |
| Molecular Formula: | C20 H23 F N4 O S2 |
| Smiles: | [H]c1nc(c2c(c3c(cccc3s2)F)n1)SCC(NCCN1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8055 |
| logD: | 2.5123 |
| logSw: | -4.0713 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.767 |
| InChI Key: | SEAHRYBWSUWKHL-UHFFFAOYSA-N |