methyl 7-methyl-2-[(1-methyl-1H-pyrazol-4-yl)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-[(1-methyl-1H-pyrazol-4-yl)methylidene]-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 7-methyl-2-[(1-methyl-1H-pyrazol-4-yl)methylidene]-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | Y500-8026 |
| Compound Name: | methyl 7-methyl-2-[(1-methyl-1H-pyrazol-4-yl)methylidene]-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 394.45 |
| Molecular Formula: | C20 H18 N4 O3 S |
| Smiles: | CC1=C(C(c2ccccc2)N2C(=N1)SC(=C/c1cnn(C)c1)\C2=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1961 |
| logD: | 2.1961 |
| logSw: | -2.2989 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.977 |
| InChI Key: | YCAUFPOOQZVRFO-QGZVFWFLSA-N |