3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
Chemical Structure Depiction of
3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | F145-0711 |
| Compound Name: | 3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide |
| Molecular Weight: | 516.68 |
| Molecular Formula: | C25 H32 N4 O4 S2 |
| Smiles: | CC(C)(C)C1CCc2c3C(NC(CCC(NCCc4ccc(cc4)S(N)(=O)=O)=O)=Nc3sc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5984 |
| logD: | 2.5977 |
| logSw: | -3.2261 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 109.639 |
| InChI Key: | NJAFWGUPKHTOEA-MRXNPFEDSA-N |