4-[4-oxo-2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)thieno[3,2-d]pyrimidin-3(4H)-yl]-N-[2-(4-sulfamoylphenyl)ethyl]butanamide
Chemical Structure Depiction of
4-[4-oxo-2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)thieno[3,2-d]pyrimidin-3(4H)-yl]-N-[2-(4-sulfamoylphenyl)ethyl]butanamide
4-[4-oxo-2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)thieno[3,2-d]pyrimidin-3(4H)-yl]-N-[2-(4-sulfamoylphenyl)ethyl]butanamide
Compound characteristics
| Compound ID: | K292-2040 |
| Compound Name: | 4-[4-oxo-2-({2-oxo-2-[(1,3-thiazol-2-yl)amino]ethyl}sulfanyl)thieno[3,2-d]pyrimidin-3(4H)-yl]-N-[2-(4-sulfamoylphenyl)ethyl]butanamide |
| Molecular Weight: | 592.74 |
| Molecular Formula: | C23 H24 N6 O5 S4 |
| Smiles: | C(CC(NCCc1ccc(cc1)S(N)(=O)=O)=O)CN1C(=Nc2ccsc2C1=O)SCC(Nc1nccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5773 |
| logD: | 0.5766 |
| logSw: | -2.1189 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 135.312 |
| InChI Key: | DRGLEGKGBWYBGO-UHFFFAOYSA-N |