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 |