ethyl 2-[(2-hydroxy-3-nitrophenyl)methylidene]-7-methyl-3-oxo-5-(3,4,5-trimethoxyphenyl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 2-[(2-hydroxy-3-nitrophenyl)methylidene]-7-methyl-3-oxo-5-(3,4,5-trimethoxyphenyl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 2-[(2-hydroxy-3-nitrophenyl)methylidene]-7-methyl-3-oxo-5-(3,4,5-trimethoxyphenyl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 4490-2390 |
| Compound Name: | ethyl 2-[(2-hydroxy-3-nitrophenyl)methylidene]-7-methyl-3-oxo-5-(3,4,5-trimethoxyphenyl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 555.56 |
| Molecular Formula: | C26 H25 N3 O9 S |
| Smiles: | CCOC(C1C(c2cc(c(c(c2)OC)OC)OC)N2C(=NC=1C)SC(=C\c1cccc(c1O)[N+]([O-])=O)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0939 |
| logD: | 2.4005 |
| logSw: | -4.2811 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 117.285 |
| InChI Key: | MXKCQDLPIZDSJM-OAQYLSRUSA-N |