ethyl 2-{2-[3-(difluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]acetamido}-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[3-(difluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]acetamido}-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carboxylate
ethyl 2-{2-[3-(difluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]acetamido}-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carboxylate
Compound characteristics
| Compound ID: | Y504-5140 |
| Compound Name: | ethyl 2-{2-[3-(difluoromethyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl]acetamido}-5,6-dihydro-4H-4,7-ethanothieno[2,3-b]pyridine-3-carboxylate |
| Molecular Weight: | 450.51 |
| Molecular Formula: | C21 H24 F2 N4 O3 S |
| Smiles: | CCOC(c1c2C3CCN(CC3)c2sc1NC(Cn1c2CCCc2c(C(F)F)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.065 |
| logD: | 2.7484 |
| logSw: | -3.0664 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.841 |
| InChI Key: | RSOVNCZHGYIYTC-UHFFFAOYSA-N |