2-[(6-methyl-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-[(6-methyl-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-[4-(propan-2-yl)phenyl]acetamide
2-[(6-methyl-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | F143-0068 |
| Compound Name: | 2-[(6-methyl-7-oxo-3-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl)sulfanyl]-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 482.64 |
| Molecular Formula: | C23 H22 N4 O2 S3 |
| Smiles: | CC(C)c1ccc(cc1)NC(CSC1=NC2=C(C(N1C)=O)SC(N2c1ccccc1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7471 |
| logD: | 4.7471 |
| logSw: | -4.4084 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.753 |
| InChI Key: | IHZQYILIIFEEAA-UHFFFAOYSA-N |