ethyl 2-[(2H-1,3-benzodioxol-5-yl)methylidene]-7-methyl-5-(naphthalen-1-yl)-3-oxo-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]-7-methyl-5-(naphthalen-1-yl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(2H-1,3-benzodioxol-5-yl)methylidene]-7-methyl-5-(naphthalen-1-yl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 8009-3547 |
| Compound Name: | ethyl 2-[(2H-1,3-benzodioxol-5-yl)methylidene]-7-methyl-5-(naphthalen-1-yl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 498.56 |
| Molecular Formula: | C28 H22 N2 O5 S |
| Smiles: | CCOC(C1C(c2cccc3ccccc23)N2C(=NC=1C)SC(=C\c1ccc3c(c1)OCO3)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5651 |
| logD: | 5.5651 |
| logSw: | -6.4982 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 62.591 |
| InChI Key: | FHBJJFCRIGPXDI-RUZDIDTESA-N |