methyl 3-{2-[2-(4-chlorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamido}thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-{2-[2-(4-chlorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamido}thiophene-2-carboxylate
methyl 3-{2-[2-(4-chlorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamido}thiophene-2-carboxylate
Compound characteristics
| Compound ID: | G419-0670 |
| Compound Name: | methyl 3-{2-[2-(4-chlorophenyl)-4-oxopyrazolo[1,5-a]pyrazin-5(4H)-yl]acetamido}thiophene-2-carboxylate |
| Molecular Weight: | 442.88 |
| Molecular Formula: | C20 H15 Cl N4 O4 S |
| Smiles: | COC(c1c(ccs1)NC(CN1C=Cn2c(cc(c3ccc(cc3)[Cl])n2)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5534 |
| logD: | 2.5257 |
| logSw: | -3.5094 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.614 |
| InChI Key: | UNUUZBKTFNSPTJ-UHFFFAOYSA-N |