methyl 2-[(1-ethyl-1H-pyrazol-4-yl)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-[(1-ethyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 2-[(1-ethyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | Y502-2326 |
| Compound Name: | methyl 2-[(1-ethyl-1H-pyrazol-4-yl)methylidene]-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 408.48 |
| Molecular Formula: | C21 H20 N4 O3 S |
| Smiles: | CCn1cc(\C=C2/C(N3C(C(=C(C)N=C3S2)C(=O)OC)c2ccccc2)=O)cn1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6215 |
| logD: | 2.6215 |
| logSw: | -2.6519 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.669 |
| InChI Key: | OVDWVHTYUFMKQW-GOSISDBHSA-N |