N-[(2,3-dimethoxyphenyl)methyl]-2-({3-[4-(4-fluorophenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[(2,3-dimethoxyphenyl)methyl]-2-({3-[4-(4-fluorophenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamide
N-[(2,3-dimethoxyphenyl)methyl]-2-({3-[4-(4-fluorophenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | L981-0436 |
| Compound Name: | N-[(2,3-dimethoxyphenyl)methyl]-2-({3-[4-(4-fluorophenyl)piperazin-1-yl]pyrazin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 497.59 |
| Molecular Formula: | C25 H28 F N5 O3 S |
| Smiles: | COc1cccc(CNC(CSc2c(nccn2)N2CCN(CC2)c2ccc(cc2)F)=O)c1OC |
| Stereo: | ACHIRAL |
| logP: | 3.9499 |
| logD: | 3.9499 |
| logSw: | -3.9785 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.659 |
| InChI Key: | IICWNKHDANYJSX-UHFFFAOYSA-N |