ethyl 2-{2-[(5-ethyl-4,6-dioxo-1,4,5,6-tetrahydropyrimidin-2-yl)sulfanyl]acetamido}-1,3-benzothiazole-6-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(5-ethyl-4,6-dioxo-1,4,5,6-tetrahydropyrimidin-2-yl)sulfanyl]acetamido}-1,3-benzothiazole-6-carboxylate
ethyl 2-{2-[(5-ethyl-4,6-dioxo-1,4,5,6-tetrahydropyrimidin-2-yl)sulfanyl]acetamido}-1,3-benzothiazole-6-carboxylate
Compound characteristics
| Compound ID: | 5493-0039 |
| Compound Name: | ethyl 2-{2-[(5-ethyl-4,6-dioxo-1,4,5,6-tetrahydropyrimidin-2-yl)sulfanyl]acetamido}-1,3-benzothiazole-6-carboxylate |
| Molecular Weight: | 434.49 |
| Molecular Formula: | C18 H18 N4 O5 S2 |
| Smiles: | CCC1C(NC(=NC1=O)SCC(Nc1nc2ccc(cc2s1)C(=O)OCC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5483 |
| logD: | -2.6354 |
| logSw: | -2.9784 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.959 |
| InChI Key: | MZVCDPFAHQTOEM-UHFFFAOYSA-N |