2-{[5-(4-tert-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(4-tert-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
2-{[5-(4-tert-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | C716-0875 |
| Compound Name: | 2-{[5-(4-tert-butylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,4-dimethylphenyl)acetamide |
| Molecular Weight: | 485.62 |
| Molecular Formula: | C24 H27 N3 O4 S2 |
| Smiles: | Cc1ccc(c(C)c1)NC(CSC1NC(C(=CN=1)S(c1ccc(cc1)C(C)(C)C)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2956 |
| logD: | 2.6538 |
| logSw: | -4.1649 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.442 |
| InChI Key: | XJYSOBHPEXDDAC-UHFFFAOYSA-N |