methyl 5-(1,5-dimethyl-1H-pyrazol-4-yl)-7-methyl-3-oxo-2-[(2,3,4-trimethoxyphenyl)methylidene]-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-3-oxo-2-[(2,3,4-trimethoxyphenyl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
methyl 5-(1,5-dimethyl-1H-pyrazol-4-yl)-7-methyl-3-oxo-2-[(2,3,4-trimethoxyphenyl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | Y500-3687 |
| Compound Name: | methyl 5-(1,5-dimethyl-1H-pyrazol-4-yl)-7-methyl-3-oxo-2-[(2,3,4-trimethoxyphenyl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate |
| Molecular Weight: | 498.56 |
| Molecular Formula: | C24 H26 N4 O6 S |
| Smiles: | CC1=C(C(c2cnn(C)c2C)N2C(=N1)SC(=C\c1ccc(c(c1OC)OC)OC)\C2=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4422 |
| logD: | 2.4422 |
| logSw: | -2.5863 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.718 |
| InChI Key: | AHHFSOZHQSBVQP-LJQANCHMSA-N |