N-[(5-bromo-2-methoxyphenyl)methyl]-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(5-bromo-2-methoxyphenyl)methyl]-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
N-[(5-bromo-2-methoxyphenyl)methyl]-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F718-0668 |
| Compound Name: | N-[(5-bromo-2-methoxyphenyl)methyl]-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 492.39 |
| Molecular Formula: | C20 H15 Br F N3 O2 S2 |
| Smiles: | [H]c1nc(c2c(c3c(cccc3s2)F)n1)SCC(NCc1cc(ccc1OC)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1825 |
| logD: | 5.1824 |
| logSw: | -5.271 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.242 |
| InChI Key: | RVDCEAPKUVWUGX-UHFFFAOYSA-N |