2-({6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-(3-methylbutyl)acetamide
Chemical Structure Depiction of
2-({6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-(3-methylbutyl)acetamide
2-({6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-(3-methylbutyl)acetamide
Compound characteristics
| Compound ID: | M179-3704 |
| Compound Name: | 2-({6-[4-(2-fluorophenyl)piperazin-1-yl]pyrimidin-4-yl}sulfanyl)-N-(3-methylbutyl)acetamide |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C21 H28 F N5 O S |
| Smiles: | CC(C)CCNC(CSc1cc(ncn1)N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2011 |
| logD: | 4.201 |
| logSw: | -4.0935 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.598 |
| InChI Key: | XFVLRAPTDZVCRE-UHFFFAOYSA-N |