benzyl [3-(4-methylphenyl)-5-oxo-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-4(5H)-yl]acetate
Chemical Structure Depiction of
benzyl [3-(4-methylphenyl)-5-oxo-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-4(5H)-yl]acetate
benzyl [3-(4-methylphenyl)-5-oxo-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-4(5H)-yl]acetate
Compound characteristics
| Compound ID: | C746-0577 |
| Compound Name: | benzyl [3-(4-methylphenyl)-5-oxo-1-sulfanylidene-1H-[1,3]thiazolo[3,4-a]quinazolin-4(5H)-yl]acetate |
| Molecular Weight: | 472.58 |
| Molecular Formula: | C26 H20 N2 O3 S2 |
| Smiles: | Cc1ccc(cc1)C1=C2N(CC(=O)OCc3ccccc3)C(c3ccccc3N2C(=S)S1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7366 |
| logD: | 5.7366 |
| logSw: | -5.4474 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 38.322 |
| InChI Key: | SDSXCVIQIHCYHL-UHFFFAOYSA-N |