N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)butanamide
Chemical Structure Depiction of
N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)butanamide
N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)butanamide
Compound characteristics
| Compound ID: | V002-4128 |
| Compound Name: | N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)butanamide |
| Molecular Weight: | 554.64 |
| Molecular Formula: | C28 H31 F N4 O5 S |
| Salt: | not_available |
| Smiles: | CCCC(Nc1ccc(c(c1)S(NCc1ccc2c(c1)OCO2)(=O)=O)N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0867 |
| logD: | 5.0863 |
| logSw: | -4.8601 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.372 |
| InChI Key: | FOMQQDAHCQGHEM-UHFFFAOYSA-N |