ethyl 5-(2H-1,3-benzodioxol-5-yl)-2-[(5-chloro-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-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-[(5-chloro-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(2H-1,3-benzodioxol-5-yl)-2-[(5-chloro-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 8008-9634 |
| Compound Name: | ethyl 5-(2H-1,3-benzodioxol-5-yl)-2-[(5-chloro-2-hydroxyphenyl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 498.94 |
| Molecular Formula: | C24 H19 Cl N2 O6 S |
| Smiles: | CCOC(C1C(c2ccc3c(c2)OCO3)N2C(=NC=1C)SC(=C\c1cc(ccc1O)[Cl])\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9141 |
| logD: | 4.8681 |
| logSw: | -4.8134 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.411 |
| InChI Key: | CKWSLPZSVZOLTK-NRFANRHFSA-N |