7-[(4-ethoxyphenyl)methylidene]-3-(4-nitrophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
7-[(4-ethoxyphenyl)methylidene]-3-(4-nitrophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
7-[(4-ethoxyphenyl)methylidene]-3-(4-nitrophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
Compound ID: | 4268-0060 |
Compound Name: | 7-[(4-ethoxyphenyl)methylidene]-3-(4-nitrophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
Molecular Weight: | 410.45 |
Molecular Formula: | C20 H18 N4 O4 S |
Smiles: | CCOc1ccc(/C=C2/C(N3CN(CN=C3S2)c2ccc(cc2)[N+]([O-])=O)=O)cc1 |
Stereo: | ACHIRAL |
logP: | 4.8993 |
logD: | 4.8735 |
logSw: | -4.4794 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 70.011 |
InChI Key: | YCQMJXMKVBTZMF-UHFFFAOYSA-N |