2-[(3-benzyl-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-[(3-benzyl-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
2-[(3-benzyl-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | K292-0097 |
| Compound Name: | 2-[(3-benzyl-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide |
| Molecular Weight: | 514.64 |
| Molecular Formula: | C23 H22 N4 O4 S3 |
| Smiles: | C(CNC(CSC1=Nc2ccsc2C(N1Cc1ccccc1)=O)=O)c1ccc(cc1)S(N)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2033 |
| logD: | 2.2026 |
| logSw: | -2.6636 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.705 |
| InChI Key: | WMMAFYUMJBSYFH-UHFFFAOYSA-N |