N-ethyl-N-(3-methylphenyl)-2-{[3-(2-methylphenyl)-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-ethyl-N-(3-methylphenyl)-2-{[3-(2-methylphenyl)-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
N-ethyl-N-(3-methylphenyl)-2-{[3-(2-methylphenyl)-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K286-4108 |
| Compound Name: | N-ethyl-N-(3-methylphenyl)-2-{[3-(2-methylphenyl)-7-oxo-6-phenyl-2-sulfanylidene-2,3,6,7-tetrahydro[1,3]thiazolo[4,5-d]pyrimidin-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 558.74 |
| Molecular Formula: | C29 H26 N4 O2 S3 |
| Smiles: | CCN(C(CSC1=NC2=C(C(N1c1ccccc1)=O)SC(N2c1ccccc1C)=S)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.1436 |
| logD: | 6.1436 |
| logSw: | -5.4175 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 41.745 |
| InChI Key: | CUBSRFHQLARLLU-UHFFFAOYSA-N |