6-{4-[2-(4-chlorophenoxy)ethyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-{4-[2-(4-chlorophenoxy)ethyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
6-{4-[2-(4-chlorophenoxy)ethyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F818-0217 |
| Compound Name: | 6-{4-[2-(4-chlorophenoxy)ethyl]piperazine-1-sulfonyl}-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 453.96 |
| Molecular Formula: | C19 H20 Cl N3 O4 S2 |
| Smiles: | C1CN(CCN1CCOc1ccc(cc1)[Cl])S(c1ccc2c(c1)SC(N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6957 |
| logD: | 3.671 |
| logSw: | -4.2742 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.034 |
| InChI Key: | RERPRPPYFCSOAY-UHFFFAOYSA-N |