prop-2-en-1-yl (2Z)-5-[4-(acetyloxy)phenyl]-2-[(2-fluorophenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
prop-2-en-1-yl (2Z)-5-[4-(acetyloxy)phenyl]-2-[(2-fluorophenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
prop-2-en-1-yl (2Z)-5-[4-(acetyloxy)phenyl]-2-[(2-fluorophenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | IB01-3697 |
| Compound Name: | prop-2-en-1-yl (2Z)-5-[4-(acetyloxy)phenyl]-2-[(2-fluorophenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 492.53 |
| Molecular Formula: | C26 H21 F N2 O5 S |
| Smiles: | CC1=C(C(c2ccc(cc2)OC(C)=O)N2C(=N1)SC(=C/c1ccccc1F)\C2=O)C(=O)OCC=C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.16 |
| logD: | 4.16 |
| logSw: | -5.14 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 148.24 |
| InChI Key: | WCJAZASVYGUOJY-HSZRJFAPSA-N |