ethyl 2-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-5-(3-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-5-(3-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-5-(3-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 4489-4375 |
| Compound Name: | ethyl 2-[(6-chloro-2H-1,3-benzodioxol-5-yl)methylidene]-5-(3-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 512.97 |
| Molecular Formula: | C25 H21 Cl N2 O6 S |
| Smiles: | CCOC(C1C(c2cccc(c2)OC)N2C(=NC=1C)SC(=C\c1cc3c(cc1[Cl])OCO3)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.973 |
| logD: | 4.973 |
| logSw: | -5.2207 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.407 |
| InChI Key: | FFNWPQVVWZAPLY-QFIPXVFZSA-N |