6-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-3-propyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-3-propyl-1,3-benzothiazol-2(3H)-one
6-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-3-propyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F818-1263 |
| Compound Name: | 6-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-3-propyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 445.6 |
| Molecular Formula: | C22 H27 N3 O3 S2 |
| Smiles: | CCCN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)c1cc(C)ccc1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4622 |
| logD: | 5.4622 |
| logSw: | -5.3356 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.732 |
| InChI Key: | TVXUSHYHUNOPFA-UHFFFAOYSA-N |