2-(azepane-1-carbonyl)-N-[(4-methoxyphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-N-[(4-methoxyphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
2-(azepane-1-carbonyl)-N-[(4-methoxyphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Compound characteristics
| Compound ID: | G240-1680 |
| Compound Name: | 2-(azepane-1-carbonyl)-N-[(4-methoxyphenyl)methyl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C23 H28 N2 O6 S |
| Smiles: | COc1ccc(CNS(c2ccc3c(c2)OCC(C(N2CCCCCC2)=O)O3)(=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.11 |
| logD: | 3.1099 |
| logSw: | -3.5892 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.957 |
| InChI Key: | LZXFDVPLGQWRSH-JOCHJYFZSA-N |