methyl 5-(1,5-dimethyl-1H-pyrazol-4-yl)-7-methyl-2-[(4-methylphenyl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 5-(1,5-dimethyl-1H-pyrazol-4-yl)-7-methyl-2-[(4-methylphenyl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-(1,5-dimethyl-1H-pyrazol-4-yl)-7-methyl-2-[(4-methylphenyl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | Y500-3658 |
| Compound Name: | methyl 5-(1,5-dimethyl-1H-pyrazol-4-yl)-7-methyl-2-[(4-methylphenyl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 422.5 |
| Molecular Formula: | C22 H22 N4 O3 S |
| Smiles: | CC1=C(C(c2cnn(C)c2C)N2C(=N1)SC(=C\c1ccc(C)cc1)\C2=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8956 |
| logD: | 2.8956 |
| logSw: | -3.1555 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.654 |
| InChI Key: | ADRRJOYDIVEHIO-LJQANCHMSA-N |