methyl 5-[4-(acetyloxy)phenyl]-7-methyl-3-oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-[4-(acetyloxy)phenyl]-7-methyl-3-oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-[4-(acetyloxy)phenyl]-7-methyl-3-oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 2556-1191 |
| Compound Name: | methyl 5-[4-(acetyloxy)phenyl]-7-methyl-3-oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 454.52 |
| Molecular Formula: | C22 H18 N2 O5 S2 |
| Smiles: | [H]C1(C(=C(C)N=C2N1C(/C(=C\c1cccs1)S2)=O)C(=O)OC)c1ccc(cc1)OC(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2019 |
| logD: | 3.2019 |
| logSw: | -3.4861 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.937 |
| InChI Key: | NJFBJDOKTWCYOL-LJQANCHMSA-N |