N-cyclopropyl-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]benzamide
Chemical Structure Depiction of
N-cyclopropyl-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]benzamide
N-cyclopropyl-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]benzamide
Compound characteristics
| Compound ID: | V027-0697 |
| Compound Name: | N-cyclopropyl-4-[({4-[4-(2-fluorophenyl)piperazin-1-yl]-5,6-dimethylpyrimidin-2-yl}sulfanyl)methyl]benzamide |
| Molecular Weight: | 491.63 |
| Molecular Formula: | C27 H30 F N5 O S |
| Salt: | not_available |
| Smiles: | Cc1c(C)nc(nc1N1CCN(CC1)c1ccccc1F)SCc1ccc(cc1)C(NC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0412 |
| logD: | 5.0395 |
| logSw: | -4.5624 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.652 |
| InChI Key: | KCQYCYBWSJMURQ-UHFFFAOYSA-N |