N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[3-(4-fluorophenyl)-7-oxo[1,2]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[3-(4-fluorophenyl)-7-oxo[1,2]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[3-(4-fluorophenyl)-7-oxo[1,2]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamide
Compound characteristics
| Compound ID: | M108-0226 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[3-(4-fluorophenyl)-7-oxo[1,2]thiazolo[4,5-d]pyrimidin-6(7H)-yl]acetamide |
| Molecular Weight: | 438.44 |
| Molecular Formula: | C21 H15 F N4 O4 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CN1C=Nc2c(c3ccc(cc3)F)nsc2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5485 |
| logD: | 2.5485 |
| logSw: | -2.9856 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.664 |
| InChI Key: | BLBKWLLGBHORSH-UHFFFAOYSA-N |