N-{4-[4-(2-fluorophenyl)piperazin-1-yl]-3-[(1,2,3,4-tetrahydronaphthalen-1-yl)sulfamoyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{4-[4-(2-fluorophenyl)piperazin-1-yl]-3-[(1,2,3,4-tetrahydronaphthalen-1-yl)sulfamoyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
N-{4-[4-(2-fluorophenyl)piperazin-1-yl]-3-[(1,2,3,4-tetrahydronaphthalen-1-yl)sulfamoyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | V013-3139 |
| Compound Name: | N-{4-[4-(2-fluorophenyl)piperazin-1-yl]-3-[(1,2,3,4-tetrahydronaphthalen-1-yl)sulfamoyl]phenyl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 628.72 |
| Molecular Formula: | C34 H33 F N4 O5 S |
| Salt: | not_available |
| Smiles: | C1CC(c2ccccc2C1)NS(c1cc(ccc1N1CCN(CC1)c1ccccc1F)NC(c1ccc2c(c1)OCO2)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.6515 |
| logD: | 6.6495 |
| logSw: | -6.1949 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.372 |
| InChI Key: | TWCRILDGWHFECA-NDEPHWFRSA-N |