N-[(4-methylphenyl)methyl]-2-[(4-oxo-3-{3-[(propan-2-yl)oxy]propyl}-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-[(4-oxo-3-{3-[(propan-2-yl)oxy]propyl}-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
N-[(4-methylphenyl)methyl]-2-[(4-oxo-3-{3-[(propan-2-yl)oxy]propyl}-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | K263-0490 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-[(4-oxo-3-{3-[(propan-2-yl)oxy]propyl}-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 495.66 |
| Molecular Formula: | C26 H29 N3 O3 S2 |
| Smiles: | CC(C)OCCCN1C(=Nc2c3ccccc3sc2C1=O)SCC(NCc1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7087 |
| logD: | 4.7087 |
| logSw: | -4.3629 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.188 |
| InChI Key: | SBFXMWIJTYMGMA-UHFFFAOYSA-N |