2-{6-[1-(2,5-dimethylphenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-(4-methylphenyl)acetamide
Chemical Structure Depiction of
2-{6-[1-(2,5-dimethylphenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-(4-methylphenyl)acetamide
2-{6-[1-(2,5-dimethylphenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-(4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | V022-3870 |
| Compound Name: | 2-{6-[1-(2,5-dimethylphenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}-N-(4-methylphenyl)acetamide |
| Molecular Weight: | 497.62 |
| Molecular Formula: | C28 H27 N5 O2 S |
| Smiles: | CC1=C(C(N2C(CC(Nc3ccc(C)cc3)=O)=CSC2=N1)=O)c1cc(C)n(c2cc(C)ccc2C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.0588 |
| logD: | 5.0588 |
| logSw: | -4.6607 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.501 |
| InChI Key: | DJAUWEQIWIOFOX-UHFFFAOYSA-N |