N-{6-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}benzenesulfonamide
Chemical Structure Depiction of
N-{6-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}benzenesulfonamide
N-{6-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}benzenesulfonamide
Compound characteristics
| Compound ID: | L366-0562 |
| Compound Name: | N-{6-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}benzenesulfonamide |
| Molecular Weight: | 468.51 |
| Molecular Formula: | C21 H16 N4 O5 S2 |
| Smiles: | [H]c1cc(cc2c1nc(NS(c1ccccc1)(=O)=O)s2)NC(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8358 |
| logD: | 4.4348 |
| logSw: | -4.8672 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.068 |
| InChI Key: | JHBFBNNEDLNDAM-UHFFFAOYSA-N |