N-butyl-2-({6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-methylacetamide
Chemical Structure Depiction of
N-butyl-2-({6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-methylacetamide
N-butyl-2-({6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-methylacetamide
Compound characteristics
| Compound ID: | M179-3415 |
| Compound Name: | N-butyl-2-({6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-methylacetamide |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C21 H28 F N5 O S |
| Smiles: | CCCCN(C)C(CSc1cc(ncn1)N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0874 |
| logD: | 4.0874 |
| logSw: | -4.0046 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.158 |
| InChI Key: | IMFNYUFWIYFVFF-UHFFFAOYSA-N |