ethyl 2-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 3184-0755 |
| Compound Name: | ethyl 2-[(2H-1,3-benzodioxol-5-yl)methylidene]-5-[4-methoxy-2-methyl-5-(propan-2-yl)phenyl]-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 596.7 |
| Molecular Formula: | C34 H32 N2 O6 S |
| Smiles: | CCOC(C1C(c2cc(C(C)C)c(cc2C)OC)N2C(=NC=1c1ccccc1)SC(=C/c1ccc3c(c1)OCO3)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.5851 |
| logD: | 7.5849 |
| logSw: | -5.6412 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.723 |
| InChI Key: | KMVJNPUSXPLLFF-WJOKGBTCSA-N |