N-(4-{[(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}cyclohexyl)methyl]sulfamoyl}phenyl)acetamide
Chemical Structure Depiction of
N-(4-{[(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}cyclohexyl)methyl]sulfamoyl}phenyl)acetamide
N-(4-{[(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}cyclohexyl)methyl]sulfamoyl}phenyl)acetamide
Compound characteristics
| Compound ID: | K788-2956 |
| Compound Name: | N-(4-{[(4-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-carbonyl}cyclohexyl)methyl]sulfamoyl}phenyl)acetamide |
| Molecular Weight: | 556.68 |
| Molecular Formula: | C28 H36 N4 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(NCC1CCC(CC1)C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0582 |
| logD: | 2.5898 |
| logSw: | -3.4115 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.755 |
| InChI Key: | LBAQHWKZUIEKDZ-UHFFFAOYSA-N |