2-{[3-(3,5-dimethylphenyl)-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Chemical Structure Depiction of
2-{[3-(3,5-dimethylphenyl)-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
2-{[3-(3,5-dimethylphenyl)-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | C280-1049 |
| Compound Name: | 2-{[3-(3,5-dimethylphenyl)-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide |
| Molecular Weight: | 444.59 |
| Molecular Formula: | C20 H20 N4 O2 S3 |
| Smiles: | CC1CC2=C(C(N(C(=N2)SCC(Nc2nccs2)=O)c2cc(C)cc(C)c2)=O)S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8669 |
| logD: | 3.8666 |
| logSw: | -3.8241 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.124 |
| InChI Key: | SOUAQHWZZHBHBJ-CYBMUJFWSA-N |