methyl 5-(3,4-dimethoxyphenyl)-7-methyl-2-[(3-nitrophenyl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-(3,4-dimethoxyphenyl)-7-methyl-2-[(3-nitrophenyl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-(3,4-dimethoxyphenyl)-7-methyl-2-[(3-nitrophenyl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 3236-0183 |
| Compound Name: | methyl 5-(3,4-dimethoxyphenyl)-7-methyl-2-[(3-nitrophenyl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 495.51 |
| Molecular Formula: | C24 H21 N3 O7 S |
| Smiles: | [H]C1(C(=C(C)N=C2N1C(/C(=C/c1cccc(c1)[N+]([O-])=O)S2)=O)C(=O)OC)c1ccc(c(c1)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5126 |
| logD: | 3.5126 |
| logSw: | -3.7761 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 94.81 |
| InChI Key: | FDQGQIQOOURLDD-OAQYLSRUSA-N |