N-{6-[(4-bromo-3-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}methanesulfonamide
Chemical Structure Depiction of
N-{6-[(4-bromo-3-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}methanesulfonamide
N-{6-[(4-bromo-3-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}methanesulfonamide
Compound characteristics
| Compound ID: | L366-0058 |
| Compound Name: | N-{6-[(4-bromo-3-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}methanesulfonamide |
| Molecular Weight: | 455.35 |
| Molecular Formula: | C16 H15 Br N4 O3 S2 |
| Smiles: | [H]c1cc(cc2c1nc(NS(C)(=O)=O)s2)NC(Nc1ccc(c(C)c1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7239 |
| logD: | 4.5921 |
| logSw: | -4.5821 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.17 |
| InChI Key: | ILCSCBQSTGOXTJ-UHFFFAOYSA-N |