2-({3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-({3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
2-({3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K292-0335 |
| Compound Name: | 2-({3-[(4-methoxyphenyl)methyl]-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl}sulfanyl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide |
| Molecular Weight: | 544.67 |
| Molecular Formula: | C24 H24 N4 O5 S3 |
| Smiles: | COc1ccc(CN2C(=Nc3ccsc3C2=O)SCC(NCCc2ccc(cc2)S(N)(=O)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.1857 |
| logD: | 2.185 |
| logSw: | -2.7915 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 109.249 |
| InChI Key: | DDJSXPMQWDYWLX-UHFFFAOYSA-N |