N-benzyl-2-({6-[(3-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-benzyl-2-({6-[(3-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)acetamide
N-benzyl-2-({6-[(3-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | D478-0029 |
| Compound Name: | N-benzyl-2-({6-[(3-methylphenyl)carbamamido]-1,3-benzothiazol-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 462.59 |
| Molecular Formula: | C24 H22 N4 O2 S2 |
| Smiles: | Cc1cccc(c1)NC(Nc1ccc2c(c1)sc(n2)SCC(NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8314 |
| logD: | 5.8314 |
| logSw: | -5.4474 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.823 |
| InChI Key: | MXZMIMBEQAZUJG-UHFFFAOYSA-N |