N-(4-bromo-3-methylphenyl)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Chemical Structure Depiction of
N-(4-bromo-3-methylphenyl)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
N-(4-bromo-3-methylphenyl)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Compound characteristics
| Compound ID: | G240-0539 |
| Compound Name: | N-(4-bromo-3-methylphenyl)-2-(piperidine-1-carbonyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide |
| Molecular Weight: | 495.39 |
| Molecular Formula: | C21 H23 Br N2 O5 S |
| Smiles: | Cc1cc(ccc1[Br])NS(c1ccc2c(c1)OCC(C(N1CCCCC1)=O)O2)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8451 |
| logD: | 3.8239 |
| logSw: | -3.9515 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.973 |
| InChI Key: | JGDJUWILHRKZOV-HXUWFJFHSA-N |