N-[2-(azepan-1-yl)-2-oxoethyl]-N-(4-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)-2-oxoethyl]-N-(4-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
N-[2-(azepan-1-yl)-2-oxoethyl]-N-(4-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Compound characteristics
| Compound ID: | 8015-7189 |
| Compound Name: | N-[2-(azepan-1-yl)-2-oxoethyl]-N-(4-fluorophenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide |
| Molecular Weight: | 448.51 |
| Molecular Formula: | C22 H25 F N2 O5 S |
| Smiles: | C1CCCN(CC1)C(CN(c1ccc(cc1)F)S(c1ccc2c(c1)OCCO2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.597 |
| logD: | 2.597 |
| logSw: | -3.0169 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.339 |
| InChI Key: | KBUORTNJUKXCCI-UHFFFAOYSA-N |