N-{2-[2-(3-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Chemical Structure Depiction of
N-{2-[2-(3-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
N-{2-[2-(3-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
Compound characteristics
| Compound ID: | G856-5071 |
| Compound Name: | N-{2-[2-(3-methylphenyl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6-yl]ethyl}-2,3-dihydro-1,4-benzodioxine-6-sulfonamide |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C21 H20 N4 O4 S2 |
| Smiles: | Cc1cccc(c1)c1nc2n(c(CCNS(c3ccc4c(c3)OCCO4)(=O)=O)cs2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.2795 |
| logD: | 3.2794 |
| logSw: | -3.5199 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.866 |
| InChI Key: | AFZCHOLGACLNIQ-UHFFFAOYSA-N |