N-[1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-3-methyl-1H-pyrazol-5-yl]-2-(6-fluoro-2-methyl-4-oxoquinazolin-3(4H)-yl)acetamide
Chemical Structure Depiction of
N-[1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-3-methyl-1H-pyrazol-5-yl]-2-(6-fluoro-2-methyl-4-oxoquinazolin-3(4H)-yl)acetamide
N-[1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-3-methyl-1H-pyrazol-5-yl]-2-(6-fluoro-2-methyl-4-oxoquinazolin-3(4H)-yl)acetamide
Compound characteristics
| Compound ID: | Y043-4041 |
| Compound Name: | N-[1-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-3-methyl-1H-pyrazol-5-yl]-2-(6-fluoro-2-methyl-4-oxoquinazolin-3(4H)-yl)acetamide |
| Molecular Weight: | 433.46 |
| Molecular Formula: | C19 H20 F N5 O4 S |
| Smiles: | CC1=Nc2ccc(cc2C(N1CC(Nc1cc(C)nn1C1CCS(C1)(=O)=O)=O)=O)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.2096 |
| logD: | 0.2096 |
| logSw: | -2.459 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.047 |
| InChI Key: | MSIKRRUCNPSILH-AWEZNQCLSA-N |