3-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide
Chemical Structure Depiction of
3-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide
3-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V025-7543 |
| Compound Name: | 3-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-6-methylpyrimidin-2-yl}sulfanyl)methyl]-N-[(pyridin-3-yl)methyl]benzamide |
| Molecular Weight: | 528.65 |
| Molecular Formula: | C29 H29 F N6 O S |
| Salt: | not_available |
| Smiles: | Cc1cc(nc(n1)SCc1cccc(c1)C(NCc1cccnc1)=O)N1CCN(CC1)c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 4.9128 |
| logD: | 4.9125 |
| logSw: | -4.4461 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.873 |
| InChI Key: | ISGFQVVWGWBHQB-UHFFFAOYSA-N |