methyl 2-[(2-chloro-6-fluorophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 2-[(2-chloro-6-fluorophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 2-[(2-chloro-6-fluorophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | 2388-1128 |
| Compound Name: | methyl 2-[(2-chloro-6-fluorophenyl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 442.89 |
| Molecular Formula: | C22 H16 Cl F N2 O3 S |
| Smiles: | [H]C1(C(=C(C)N=C2N1C(/C(=C/c1c(cccc1[Cl])F)S2)=O)C(=O)OC)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4802 |
| logD: | 4.4802 |
| logSw: | -4.5964 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.167 |
| InChI Key: | KVTBKWUVNSDZGS-IBGZPJMESA-N |