ethyl 5-(2H-1,3-benzodioxol-5-yl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-7-phenyl-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)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(2H-1,3-benzodioxol-5-yl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 8010-0666 |
| Compound Name: | ethyl 5-(2H-1,3-benzodioxol-5-yl)-2-[(4-hydroxyphenyl)methylidene]-3-oxo-7-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 526.57 |
| Molecular Formula: | C29 H22 N2 O6 S |
| Smiles: | CCOC(C1C(c2ccc3c(c2)OCO3)N2C(=NC=1c1ccccc1)SC(=C/c1ccc(cc1)O)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4708 |
| logD: | 5.4684 |
| logSw: | -5.332 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.71 |
| InChI Key: | RGMRCDYIMUTMQF-AREMUKBSSA-N |