3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
Chemical Structure Depiction of
3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide
Compound characteristics
| Compound ID: | F145-0589 |
| Compound Name: | 3-(4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)-N-[2-(4-sulfamoylphenyl)ethyl]propanamide |
| Molecular Weight: | 474.6 |
| Molecular Formula: | C22 H26 N4 O4 S2 |
| Smiles: | C1CCc2c3C(NC(CCC(NCCc4ccc(cc4)S(N)(=O)=O)=O)=Nc3sc2CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5371 |
| logD: | 1.5364 |
| logSw: | -2.3289 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 109.97 |
| InChI Key: | KJTXYIPBMSHTBV-UHFFFAOYSA-N |