N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)cyclohexanecarboxamide
N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)cyclohexanecarboxamide
Compound characteristics
| Compound ID: | V002-4148 |
| Compound Name: | N-(3-{[(2H-1,3-benzodioxol-5-yl)methyl]sulfamoyl}-4-[4-(2-fluorophenyl)piperazin-1-yl]phenyl)cyclohexanecarboxamide |
| Molecular Weight: | 594.71 |
| Molecular Formula: | C31 H35 F N4 O5 S |
| Salt: | not_available |
| Smiles: | C1CCC(CC1)C(Nc1ccc(c(c1)S(NCc1ccc2c(c1)OCO2)(=O)=O)N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.835 |
| logD: | 5.834 |
| logSw: | -5.8238 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.507 |
| InChI Key: | CXQYCGUJTNDCBQ-UHFFFAOYSA-N |