2-{4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-ethoxy-6-iodophenoxy}acetamide
Chemical Structure Depiction of
2-{4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-ethoxy-6-iodophenoxy}acetamide
2-{4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-ethoxy-6-iodophenoxy}acetamide
Compound characteristics
| Compound ID: | Y500-4945 |
| Compound Name: | 2-{4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]-2-ethoxy-6-iodophenoxy}acetamide |
| Molecular Weight: | 475.26 |
| Molecular Formula: | C15 H14 I N3 O5 S |
| Smiles: | CCOc1cc(C=C2C(NC(NC2=O)=S)=O)cc(c1OCC(N)=O)I |
| Stereo: | ACHIRAL |
| logP: | 1.6282 |
| logD: | 1.2027 |
| logSw: | -2.5513 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 97.896 |
| InChI Key: | LXUXBBFXHILSCW-UHFFFAOYSA-N |