N-ethyl-2-{[6-(2-methoxyphenyl)-7-oxo-3-(2-phenylethyl)-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Chemical Structure Depiction of
N-ethyl-2-{[6-(2-methoxyphenyl)-7-oxo-3-(2-phenylethyl)-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3-methylphenyl)acetamide
N-ethyl-2-{[6-(2-methoxyphenyl)-7-oxo-3-(2-phenylethyl)-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | K286-3992 |
| Compound Name: | N-ethyl-2-{[6-(2-methoxyphenyl)-7-oxo-3-(2-phenylethyl)-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}-N-(3-methylphenyl)acetamide |
| Molecular Weight: | 602.8 |
| Molecular Formula: | C31 H30 N4 O3 S3 |
| Smiles: | CCN(C(CSC1=NC2=C(C(N1c1ccccc1OC)=O)SC(N2CCc1ccccc1)=S)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.2712 |
| logD: | 6.2712 |
| logSw: | -5.3943 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 49.965 |
| InChI Key: | PGSWNBDIOWBALR-UHFFFAOYSA-N |