ethyl 5-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetamido)-1-{2-[({[(4-fluorophenyl)methyl]sulfanyl}acetyl)oxy]ethyl}-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetamido)-1-{2-[({[(4-fluorophenyl)methyl]sulfanyl}acetyl)oxy]ethyl}-1H-pyrazole-4-carboxylate
ethyl 5-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetamido)-1-{2-[({[(4-fluorophenyl)methyl]sulfanyl}acetyl)oxy]ethyl}-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | C691-0050 |
| Compound Name: | ethyl 5-(2-{[(4-fluorophenyl)methyl]sulfanyl}acetamido)-1-{2-[({[(4-fluorophenyl)methyl]sulfanyl}acetyl)oxy]ethyl}-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 563.64 |
| Molecular Formula: | C26 H27 F2 N3 O5 S2 |
| Smiles: | CCOC(c1cnn(CCOC(CSCc2ccc(cc2)F)=O)c1NC(CSCc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5941 |
| logD: | 4.2302 |
| logSw: | -4.1677 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.902 |
| InChI Key: | DPZNYBWBWUBGEC-UHFFFAOYSA-N |