N-(2,3-dimethylphenyl)-2-{[5-(4-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,3-dimethylphenyl)-2-{[5-(4-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
N-(2,3-dimethylphenyl)-2-{[5-(4-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C716-0091 |
| Compound Name: | N-(2,3-dimethylphenyl)-2-{[5-(4-methylbenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 443.54 |
| Molecular Formula: | C21 H21 N3 O4 S2 |
| Smiles: | Cc1ccc(cc1)S(C1=CN=C(NC1=O)SCC(Nc1cccc(C)c1C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0724 |
| logD: | 1.4306 |
| logSw: | -3.3223 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.442 |
| InChI Key: | KHRVZEYZYNRHTO-UHFFFAOYSA-N |