methyl 2-{2-[2-(4-fluorophenyl)-3-(hydroxymethyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamido}benzoate
Chemical Structure Depiction of
methyl 2-{2-[2-(4-fluorophenyl)-3-(hydroxymethyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamido}benzoate
methyl 2-{2-[2-(4-fluorophenyl)-3-(hydroxymethyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamido}benzoate
Compound characteristics
| Compound ID: | P165-2473 |
| Compound Name: | methyl 2-{2-[2-(4-fluorophenyl)-3-(hydroxymethyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamido}benzoate |
| Molecular Weight: | 450.43 |
| Molecular Formula: | C23 H19 F N4 O5 |
| Smiles: | COC(c1ccccc1NC(CN1C=Cn2c(C1=O)c(CO)c(c1ccc(cc1)F)n2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1133 |
| logD: | 1.1002 |
| logSw: | -2.2874 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.258 |
| InChI Key: | UABDTRRSVROWGT-UHFFFAOYSA-N |