methyl 7-methyl-2-[(4-nitrophenyl)methylidene]-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 7-methyl-2-[(4-nitrophenyl)methylidene]-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 7-methyl-2-[(4-nitrophenyl)methylidene]-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 2388-1121 |
| Compound Name: | methyl 7-methyl-2-[(4-nitrophenyl)methylidene]-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 435.46 |
| Molecular Formula: | C22 H17 N3 O5 S |
| Smiles: | [H]C1(C(=C(C)N=C2N1C(/C(=C\c1ccc(cc1)[N+]([O-])=O)S2)=O)C(=O)OC)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9716 |
| logD: | 3.9716 |
| logSw: | -4.1883 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 79.549 |
| InChI Key: | DHXNYPUSFZPJSV-LJQANCHMSA-N |