2-{[5-(3-chloro-4-methoxybenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[5-(3-chloro-4-methoxybenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
2-{[5-(3-chloro-4-methoxybenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C716-0669 |
| Compound Name: | 2-{[5-(3-chloro-4-methoxybenzene-1-sulfonyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(3,5-dimethoxyphenyl)acetamide |
| Molecular Weight: | 525.99 |
| Molecular Formula: | C21 H20 Cl N3 O7 S2 |
| Smiles: | COc1cc(cc(c1)OC)NC(CSC1NC(C(=CN=1)S(c1ccc(c(c1)[Cl])OC)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2982 |
| logD: | 0.6564 |
| logSw: | -3.2934 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 109.858 |
| InChI Key: | JIZFBIOPASZRER-UHFFFAOYSA-N |