6-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one
6-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F818-0477 |
| Compound Name: | 6-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-3-methyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C20 H23 N3 O3 S2 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)S(c1ccc2c(c1)SC(N2C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.554 |
| logD: | 4.554 |
| logSw: | -4.3573 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.519 |
| InChI Key: | SGMROJPWFZRZOA-UHFFFAOYSA-N |