N-{6-[2-(phenylsulfanyl)acetamido]-1,3-benzothiazol-2-yl}benzamide
Chemical Structure Depiction of
N-{6-[2-(phenylsulfanyl)acetamido]-1,3-benzothiazol-2-yl}benzamide
N-{6-[2-(phenylsulfanyl)acetamido]-1,3-benzothiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | F259-0066 |
| Compound Name: | N-{6-[2-(phenylsulfanyl)acetamido]-1,3-benzothiazol-2-yl}benzamide |
| Molecular Weight: | 419.52 |
| Molecular Formula: | C22 H17 N3 O2 S2 |
| Smiles: | C(C(Nc1ccc2c(c1)sc(NC(c1ccccc1)=O)n2)=O)Sc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.0266 |
| logD: | 5.024 |
| logSw: | -4.9225 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.969 |
| InChI Key: | MKFFVIMMFQFGAJ-UHFFFAOYSA-N |