N-{6-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}methanesulfonamide
Chemical Structure Depiction of
N-{6-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}methanesulfonamide
N-{6-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}methanesulfonamide
Compound characteristics
| Compound ID: | L366-0067 |
| Compound Name: | N-{6-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}methanesulfonamide |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C16 H14 N4 O5 S2 |
| Smiles: | [H]c1cc(cc2c1nc(NS(C)(=O)=O)s2)NC(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3825 |
| logD: | 3.2507 |
| logSw: | -3.8172 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.285 |
| InChI Key: | FYSGGLNSTOOWAP-UHFFFAOYSA-N |