N-benzyl-2-({6-[(2,5-dimethylphenyl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-benzyl-2-({6-[(2,5-dimethylphenyl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)acetamide
N-benzyl-2-({6-[(2,5-dimethylphenyl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | D478-0014 |
| Compound Name: | N-benzyl-2-({6-[(2,5-dimethylphenyl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 476.62 |
| Molecular Formula: | C25 H24 N4 O2 S2 |
| Smiles: | Cc1ccc(C)c(c1)NC(Nc1ccc2c(c1)sc(n2)SCC(NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5136 |
| logD: | 5.5136 |
| logSw: | -5.3155 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.125 |
| InChI Key: | MGJJPAPVTLFCMO-UHFFFAOYSA-N |