5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
Chemical Structure Depiction of
5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione
Compound characteristics
Compound ID: | 3448-4454 |
Compound Name: | 5-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-1-(3-methylphenyl)-1,3-diazinane-2,4,6-trione |
Molecular Weight: | 384.77 |
Molecular Formula: | C19 H13 Cl N2 O5 |
Smiles: | Cc1cccc(c1)N1C(C(=C/c2cc3c(cc2[Cl])OCO3)\C(NC1=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.1808 |
logD: | 2.7537 |
logSw: | -3.5177 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.506 |
InChI Key: | FHZTVUXBIHOFJK-UHFFFAOYSA-N |