3-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide
Chemical Structure Depiction of
3-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide
3-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V003-4632 |
| Compound Name: | 3-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide |
| Molecular Weight: | 542.68 |
| Molecular Formula: | C30 H31 F N6 O S |
| Salt: | not_available |
| Smiles: | Cc1c(C)nc(nc1N1CCN(CC1)c1ccccc1F)SCc1cccc(c1)C(NCc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1597 |
| logD: | 5.158 |
| logSw: | -4.8463 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.113 |
| InChI Key: | PHUKWQHVFFDEJQ-UHFFFAOYSA-N |