2-{[5-(3-chloro-4-methoxybenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(3-chloro-4-methoxybenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
2-{[5-(3-chloro-4-methoxybenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide
Compound characteristics
| Compound ID: | C716-0650 |
| Compound Name: | 2-{[5-(3-chloro-4-methoxybenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(2,6-dimethylphenyl)acetamide |
| Molecular Weight: | 493.99 |
| Molecular Formula: | C21 H20 Cl N3 O5 S2 |
| Smiles: | Cc1cccc(C)c1NC(CSC1NC(C(=CN=1)S(c1ccc(c(c1)[Cl])OC)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3438 |
| logD: | 0.7021 |
| logSw: | -3.2854 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.375 |
| InChI Key: | LERNPSRVMIXPCJ-UHFFFAOYSA-N |