N-{5-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{5-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}-4-methylbenzene-1-sulfonamide
N-{5-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | L356-0242 |
| Compound Name: | N-{5-[(2H-1,3-benzodioxol-5-yl)carbamamido]-1,3-benzothiazol-2-yl}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 482.54 |
| Molecular Formula: | C22 H18 N4 O5 S2 |
| Smiles: | [H]c1cc2c(cc1NC(Nc1ccc3c(c1)OCO3)=O)nc(NS(c1ccc(C)cc1)(=O)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.5102 |
| logD: | 5.1092 |
| logSw: | -5.4041 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 100.068 |
| InChI Key: | WPQUEEQGIUUYBZ-UHFFFAOYSA-N |