ethyl 5-(3,4-dimethoxyphenyl)-7-methyl-2-[(5-nitrofuran-2-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
ethyl 5-(3,4-dimethoxyphenyl)-7-methyl-2-[(5-nitrofuran-2-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
ethyl 5-(3,4-dimethoxyphenyl)-7-methyl-2-[(5-nitrofuran-2-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 3270-0129 |
| Compound Name: | ethyl 5-(3,4-dimethoxyphenyl)-7-methyl-2-[(5-nitrofuran-2-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 499.5 |
| Molecular Formula: | C23 H21 N3 O8 S |
| Smiles: | CCOC(C1C(c2ccc(c(c2)OC)OC)N2C(=NC=1C)SC(=C/c1ccc([N+]([O-])=O)o1)\C2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3333 |
| logD: | 3.3333 |
| logSw: | -3.6206 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 102.839 |
| InChI Key: | LPOFZFHOQVUWMQ-HXUWFJFHSA-N |