N-(1-benzylpiperidin-4-yl)-2-{6-[1-(2,5-difluorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetamide
Chemical Structure Depiction of
N-(1-benzylpiperidin-4-yl)-2-{6-[1-(2,5-difluorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetamide
N-(1-benzylpiperidin-4-yl)-2-{6-[1-(2,5-difluorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetamide
Compound characteristics
| Compound ID: | V022-0554 |
| Compound Name: | N-(1-benzylpiperidin-4-yl)-2-{6-[1-(2,5-difluorophenyl)-5-methyl-1H-pyrazol-3-yl]-7-methyl-5-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-3-yl}acetamide |
| Molecular Weight: | 588.68 |
| Molecular Formula: | C31 H30 F2 N6 O2 S |
| Salt: | not_available |
| Smiles: | CC1=C(C(N2C(CC(NC3CCN(CC3)Cc3ccccc3)=O)=CSC2=N1)=O)c1cc(C)n(c2cc(ccc2F)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.7185 |
| logD: | 2.1608 |
| logSw: | -3.9441 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.089 |
| InChI Key: | KEGBNGHFXBWJQH-UHFFFAOYSA-N |