ethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]-5-(3-ethoxy-4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]-5-(3-ethoxy-4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]-5-(3-ethoxy-4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 3871-1179 |
| Compound Name: | ethyl 2-[(2,3-dihydro-1,4-benzodioxin-6-yl)methylidene]-5-(3-ethoxy-4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 536.6 |
| Molecular Formula: | C28 H28 N2 O7 S |
| Smiles: | CCOC(C1C(c2ccc(c(c2)OCC)OC)N2C(=NC=1C)SC(=C/c1ccc3c(c1)OCCO3)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3267 |
| logD: | 3.3266 |
| logSw: | -3.4902 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 76.411 |
| InChI Key: | WWYWAARTNAIOQO-RUZDIDTESA-N |