5-{[4-(benzyloxy)-3-bromo-5-ethoxyphenyl]methylidene}-1-(3,5-dimethylphenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[4-(benzyloxy)-3-bromo-5-ethoxyphenyl]methylidene}-1-(3,5-dimethylphenyl)-1,3-diazinane-2,4,6-trione
5-{[4-(benzyloxy)-3-bromo-5-ethoxyphenyl]methylidene}-1-(3,5-dimethylphenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
Compound ID: | 2368-0122 |
Compound Name: | 5-{[4-(benzyloxy)-3-bromo-5-ethoxyphenyl]methylidene}-1-(3,5-dimethylphenyl)-1,3-diazinane-2,4,6-trione |
Molecular Weight: | 549.42 |
Molecular Formula: | C28 H25 Br N2 O5 |
Smiles: | CCOc1cc(\C=C2/C(NC(N(C2=O)c2cc(C)cc(C)c2)=O)=O)cc(c1OCc1ccccc1)[Br] |
Stereo: | ACHIRAL |
logP: | 5.7945 |
logD: | 5.7789 |
logSw: | -5.4484 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.002 |
InChI Key: | LGBRXZLUZRYNOL-UHFFFAOYSA-N |