N-(2-ethylphenyl)-2-{[3-(4-methylphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-ethylphenyl)-2-{[3-(4-methylphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
N-(2-ethylphenyl)-2-{[3-(4-methylphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F092-0510 |
| Compound Name: | N-(2-ethylphenyl)-2-{[3-(4-methylphenyl)-7-oxo-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 468.62 |
| Molecular Formula: | C22 H20 N4 O2 S3 |
| Smiles: | CCc1ccccc1NC(CSC1NC(C2=C(N=1)N(C(=S)S2)c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2089 |
| logD: | 4.2072 |
| logSw: | -4.086 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.748 |
| InChI Key: | JPNGALMDYWRTTM-UHFFFAOYSA-N |