N-{2-[2-(1-ethyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Chemical Structure Depiction of
N-{2-[2-(1-ethyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
N-{2-[2-(1-ethyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Compound characteristics
| Compound ID: | L265-0004 |
| Compound Name: | N-{2-[2-(1-ethyl-1H-benzimidazol-2-yl)ethyl]phenyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide |
| Molecular Weight: | 463.55 |
| Molecular Formula: | C25 H25 N3 O4 S |
| Smiles: | [H]C(Cc1ccccc1NS(c1ccc2c(c1)OCCO2)(=O)=O)c1nc2ccccc2n1CC |
| Stereo: | ACHIRAL |
| logP: | 4.2352 |
| logD: | 4.1955 |
| logSw: | -4.1942 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.643 |
| InChI Key: | XNGHBTHKKNEBAT-UHFFFAOYSA-N |