1-(4-chlorophenyl)-5-({3-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
1-(4-chlorophenyl)-5-({3-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione
1-(4-chlorophenyl)-5-({3-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione
Compound characteristics
| Compound ID: | 3958-4665 |
| Compound Name: | 1-(4-chlorophenyl)-5-({3-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione |
| Molecular Weight: | 424.84 |
| Molecular Formula: | C22 H17 Cl N2 O5 |
| Smiles: | CCOc1cc(/C=C2/C(NC(N(C2=O)c2ccc(cc2)[Cl])=O)=O)ccc1OCC#C |
| Stereo: | ACHIRAL |
| logP: | 2.9343 |
| logD: | 2.6312 |
| logSw: | -3.7988 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.105 |
| InChI Key: | ATWQYKBEHOUCDZ-UHFFFAOYSA-N |