N-[(3,4-dimethoxyphenyl)methyl]-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
N-[(3,4-dimethoxyphenyl)methyl]-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F718-0660 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-2-[(9-fluoro[1]benzothieno[3,2-d]pyrimidin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C21 H18 F N3 O3 S2 |
| Smiles: | [H]c1nc(c2c(c3c(cccc3s2)F)n1)SCC(NCc1ccc(c(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9041 |
| logD: | 3.904 |
| logSw: | -4.2097 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.873 |
| InChI Key: | PTNVKNIOYXETGR-UHFFFAOYSA-N |