7-[(thiophen-2-yl)methylidene]-3-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Chemical Structure Depiction of
7-[(thiophen-2-yl)methylidene]-3-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
7-[(thiophen-2-yl)methylidene]-3-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Compound characteristics
| Compound ID: | 5521-0058 |
| Compound Name: | 7-[(thiophen-2-yl)methylidene]-3-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one |
| Molecular Weight: | 417.5 |
| Molecular Formula: | C19 H19 N3 O4 S2 |
| Smiles: | COc1cc(cc(c1OC)OC)N1CN=C2N(C1)C(/C(=C/c1cccs1)S2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8426 |
| logD: | 3.8372 |
| logSw: | -4.0032 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.502 |
| InChI Key: | TZHOLHKHPQPLGC-UHFFFAOYSA-N |