1-(4-bromophenyl)-3-{[(3-fluorophenyl)methyl]sulfanyl}pyrazin-2(1H)-one
Chemical Structure Depiction of
1-(4-bromophenyl)-3-{[(3-fluorophenyl)methyl]sulfanyl}pyrazin-2(1H)-one
1-(4-bromophenyl)-3-{[(3-fluorophenyl)methyl]sulfanyl}pyrazin-2(1H)-one
Compound characteristics
| Compound ID: | G195-0945 |
| Compound Name: | 1-(4-bromophenyl)-3-{[(3-fluorophenyl)methyl]sulfanyl}pyrazin-2(1H)-one |
| Molecular Weight: | 391.26 |
| Molecular Formula: | C17 H12 Br F N2 O S |
| Smiles: | C(c1cccc(c1)F)SC1C(N(C=CN=1)c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6706 |
| logD: | 3.6706 |
| logSw: | -3.9803 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 23.6427 |
| InChI Key: | IMIYZELLNVYUSY-UHFFFAOYSA-N |