2-({3-[(4-methylphenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-({3-[(4-methylphenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide
2-({3-[(4-methylphenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | K263-0083 |
| Compound Name: | 2-({3-[(4-methylphenyl)methyl]-4-oxo-3,4-dihydro[1]benzothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 479.62 |
| Molecular Formula: | C25 H25 N3 O3 S2 |
| Smiles: | Cc1ccc(CN2C(=Nc3c4ccccc4sc3C2=O)SCC(NCC2CCCO2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.098 |
| logD: | 4.098 |
| logSw: | -4.1093 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.392 |
| InChI Key: | NTTXTAJTRHBLGK-GOSISDBHSA-N |