7-[(4-methoxyphenyl)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-methoxyphenyl)methylidene]-3-(4-nitrophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
7-[(4-methoxyphenyl)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: | 4268-0051 |
| Compound Name: | 7-[(4-methoxyphenyl)methylidene]-3-(4-nitrophenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
| Molecular Weight: | 396.42 |
| Molecular Formula: | C19 H16 N4 O4 S |
| Smiles: | COc1ccc(/C=C2/C(N3CN(CN=C3S2)c2ccc(cc2)[N+]([O-])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5127 |
| logD: | 4.4869 |
| logSw: | -4.3573 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.432 |
| InChI Key: | KEEXQTFVWYGYOZ-UHFFFAOYSA-N |