2-[(7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide
Chemical Structure Depiction of
2-[(7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide
2-[(7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide
Compound characteristics
| Compound ID: | F092-0425 |
| Compound Name: | 2-[(7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-(4-phenylbutan-2-yl)acetamide |
| Molecular Weight: | 482.64 |
| Molecular Formula: | C23 H22 N4 O2 S3 |
| Smiles: | CC(CCc1ccccc1)NC(CSC1NC(C2=C(N=1)N(C(=S)S2)c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.79 |
| logD: | 3.7884 |
| logSw: | -4.0824 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.209 |
| InChI Key: | FLPAEUDFSCVEBH-HNNXBMFYSA-N |