6-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-3-ethyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-3-ethyl-1,3-benzothiazol-2(3H)-one
6-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-3-ethyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F818-0868 |
| Compound Name: | 6-[4-(2,3-dimethylphenyl)piperazine-1-sulfonyl]-3-ethyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 431.57 |
| Molecular Formula: | C21 H25 N3 O3 S2 |
| Smiles: | CCN1C(=O)Sc2cc(ccc12)S(N1CCN(CC1)c1cccc(C)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9384 |
| logD: | 4.9384 |
| logSw: | -4.6349 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.478 |
| InChI Key: | TUZSCAMWJUGKFL-UHFFFAOYSA-N |