methyl 5-(2-chlorophenyl)-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-(2-chlorophenyl)-7-methyl-2-[(3-nitrophenyl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-(2-chlorophenyl)-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: | 1611-4782 |
| Compound Name: | methyl 5-(2-chlorophenyl)-7-methyl-2-[(3-nitrophenyl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 469.9 |
| Molecular Formula: | C22 H16 Cl N3 O5 S |
| Smiles: | [H]C1(C(=C(C)N=C2N1C(/C(=C\c1cccc(c1)[N+]([O-])=O)S2)=O)C(=O)OC)c1ccccc1[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4273 |
| logD: | 4.4273 |
| logSw: | -4.6312 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 79.549 |
| InChI Key: | RLKLADUDWLZMDS-IBGZPJMESA-N |