5-{[4-(benzyloxy)-2-bromo-5-ethoxyphenyl]methylidene}-1-(4-tert-butylphenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-{[4-(benzyloxy)-2-bromo-5-ethoxyphenyl]methylidene}-1-(4-tert-butylphenyl)-1,3-diazinane-2,4,6-trione
5-{[4-(benzyloxy)-2-bromo-5-ethoxyphenyl]methylidene}-1-(4-tert-butylphenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
Compound ID: | 3269-0481 |
Compound Name: | 5-{[4-(benzyloxy)-2-bromo-5-ethoxyphenyl]methylidene}-1-(4-tert-butylphenyl)-1,3-diazinane-2,4,6-trione |
Molecular Weight: | 577.48 |
Molecular Formula: | C30 H29 Br N2 O5 |
Smiles: | CCOc1cc(\C=C2/C(NC(N(C2=O)c2ccc(cc2)C(C)(C)C)=O)=O)c(cc1OCc1ccccc1)[Br] |
Stereo: | ACHIRAL |
logP: | 5.6191 |
logD: | 4.6288 |
logSw: | -5.4757 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 67.915 |
InChI Key: | PRLKLKSSMRVYJQ-UHFFFAOYSA-N |