2-[(6-ethyl-7-oxo-3-phenyl-6,7-dihydro[1,2]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide
Chemical Structure Depiction of
2-[(6-ethyl-7-oxo-3-phenyl-6,7-dihydro[1,2]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide
2-[(6-ethyl-7-oxo-3-phenyl-6,7-dihydro[1,2]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide
Compound characteristics
| Compound ID: | M109-0531 |
| Compound Name: | 2-[(6-ethyl-7-oxo-3-phenyl-6,7-dihydro[1,2]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-[3-(methylsulfanyl)phenyl]acetamide |
| Molecular Weight: | 468.62 |
| Molecular Formula: | C22 H20 N4 O2 S3 |
| Smiles: | CCN1C(=Nc2c(c3ccccc3)nsc2C1=O)SCC(Nc1cccc(c1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4879 |
| logD: | 4.4879 |
| logSw: | -4.2875 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.655 |
| InChI Key: | KHBLWUBYKLHLBN-UHFFFAOYSA-N |