N-(2-{1-[(4-fluorophenyl)methyl]-5-methyl-1H-imidazol-2-yl}ethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Chemical Structure Depiction of
N-(2-{1-[(4-fluorophenyl)methyl]-5-methyl-1H-imidazol-2-yl}ethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
N-(2-{1-[(4-fluorophenyl)methyl]-5-methyl-1H-imidazol-2-yl}ethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Compound characteristics
| Compound ID: | T161-1158 |
| Compound Name: | N-(2-{1-[(4-fluorophenyl)methyl]-5-methyl-1H-imidazol-2-yl}ethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide |
| Molecular Weight: | 431.48 |
| Molecular Formula: | C21 H22 F N3 O4 S |
| Smiles: | Cc1cnc(CCNS(c2ccc3c(c2)OCCO3)(=O)=O)n1Cc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 2.3076 |
| logD: | 2.2633 |
| logSw: | -2.7226 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.822 |
| InChI Key: | FBGVOFNCBUXXPW-UHFFFAOYSA-N |