N-(3-chloro-4-fluorophenyl)-2-{[3-(phenylsulfanyl)pyrazin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-2-{[3-(phenylsulfanyl)pyrazin-2-yl]sulfanyl}acetamide
N-(3-chloro-4-fluorophenyl)-2-{[3-(phenylsulfanyl)pyrazin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | L898-0229 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-2-{[3-(phenylsulfanyl)pyrazin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 405.9 |
| Molecular Formula: | C18 H13 Cl F N3 O S2 |
| Smiles: | C(C(Nc1ccc(c(c1)[Cl])F)=O)Sc1c(nccn1)Sc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7056 |
| logD: | 4.6958 |
| logSw: | -4.9973 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.203 |
| InChI Key: | XTOGFCKEXXJXFY-UHFFFAOYSA-N |