ethyl 3-[2-({3-[4-(4-fluorophenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]benzoate
Chemical Structure Depiction of
ethyl 3-[2-({3-[4-(4-fluorophenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]benzoate
ethyl 3-[2-({3-[4-(4-fluorophenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]benzoate
Compound characteristics
| Compound ID: | L981-0395 |
| Compound Name: | ethyl 3-[2-({3-[4-(4-fluorophenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamido]benzoate |
| Molecular Weight: | 495.58 |
| Molecular Formula: | C25 H26 F N5 O3 S |
| Smiles: | CCOC(c1cccc(c1)NC(CSc1c(nccn1)N1CCN(CC1)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9097 |
| logD: | 4.9097 |
| logSw: | -4.6299 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.743 |
| InChI Key: | UQDBWKIKHRREPQ-UHFFFAOYSA-N |