ethyl 5-(2H-1,3-benzodioxol-5-yl)-3-oxo-7-phenyl-2-[(pyridin-3-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-(2H-1,3-benzodioxol-5-yl)-3-oxo-7-phenyl-2-[(pyridin-3-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(2H-1,3-benzodioxol-5-yl)-3-oxo-7-phenyl-2-[(pyridin-3-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 8010-0330 |
| Compound Name: | ethyl 5-(2H-1,3-benzodioxol-5-yl)-3-oxo-7-phenyl-2-[(pyridin-3-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 511.56 |
| Molecular Formula: | C28 H21 N3 O5 S |
| Smiles: | CCOC(C1C(c2ccc3c(c2)OCO3)N2C(=NC=1c1ccccc1)SC(=C/c1cccnc1)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9305 |
| logD: | 4.9305 |
| logSw: | -4.3943 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.61 |
| InChI Key: | HMEVQGOVSJJWNC-RUZDIDTESA-N |